NEDOCROMIL SODIUM TRIHYDRATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H15NO7.2Na.3H2O
Molecular Weight	469.3503
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of NEDOCROMIL SODIUM TRIHYDRATE

Structure Search

SMILES

O.O.O.[Na+].[Na+].CCCC1=C2OC(=CC(=O)C2=CC3=C1N(CC)C(=CC3=O)C([O-])=O)C([O-])=O

InChI

InChIKey=QRUGNCIIESVHAR-UHFFFAOYSA-L

InChI=1S/C19H17NO7.2Na.3H2O/c1-3-5-9-16-10(13(21)7-12(18(23)24)20(16)4-2)6-11-14(22)8-15(19(25)26)27-17(9)11;;;;;/h6-8H,3-5H2,1-2H3,(H,23,24)(H,25,26);;;3*1H2/q;2*+1;;;/p-2

HIDE SMILES / InChI

Molecular Formula	C19H15NO7
Molecular Weight	369.3249
Charge	-2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:38:36 UTC 2023` Edited by `admin` on `Fri Dec 15 19:38:36 UTC 2023`
Record UNII	5N22F63WQ6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NEDOCROMIL SODIUM TRIHYDRATE

Common Name

English

4H-PYRANO(3,2-G)QUINOLINE-2,8-DICARBOXYLIC ACID, 9-ETHYL-6,9-DIHYDRO-4,6-DIOXO-10-PROPYL-, DISODIUM SALT, TRIHYDRATE

Systematic Name

English

4H-PYRANO(3,2-G)QUINOLINE-2,8-DICARBOXYLIC ACID, 9-ETHYL-6,9-DIHYDRO-4,6-DIOXO-10-PROPYL-, SODIUM SALT, HYDRATE (1:2:3)

Systematic Name

English

Code System Code Type Description

FDA UNII

5N22F63WQ6

Created by admin on Fri Dec 15 19:38:36 UTC 2023 , Edited by admin on Fri Dec 15 19:38:36 UTC 2023

PRIMARY

CAS

111681-48-2

Created by admin on Fri Dec 15 19:38:36 UTC 2023 , Edited by admin on Fri Dec 15 19:38:36 UTC 2023

PRIMARY

PUBCHEM

119025832

Created by admin on Fri Dec 15 19:38:36 UTC 2023 , Edited by admin on Fri Dec 15 19:38:36 UTC 2023

PRIMARY

CAS

114742-73-3

Created by admin on Fri Dec 15 19:38:36 UTC 2023 , Edited by admin on Fri Dec 15 19:38:36 UTC 2023

NON-SPECIFIC STOICHIOMETRY

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