PENTAPIPERIUM METHYLSULFATE

Details

Stereochemistry	MIXED
Molecular Formula	C19H30NO2.CH3O4S
Molecular Weight	415.544
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PENTAPIPERIUM METHYLSULFATE

Structure Search

SMILES

COS([O-])(=O)=O.CCC(C)C(C(=O)OC1CC[N+](C)(C)CC1)C2=CC=CC=C2

InChI

InChIKey=YGURFDXYQNOJCS-UHFFFAOYSA-M

InChI=1S/C19H30NO2.CH4O4S/c1-5-15(2)18(16-9-7-6-8-10-16)19(21)22-17-11-13-20(3,4)14-12-17;1-5-6(2,3)4/h6-10,15,17-18H,5,11-14H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C19H30NO2
Molecular Weight	304.447
Charge	1
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	CH3O4S
Molecular Weight	111.097
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 17:54:00 UTC 2023` Edited by `admin` on `Fri Dec 15 17:54:00 UTC 2023`
Record UNII	Y8B7PF4062
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PENTAPIPERIUM METHYLSULFATE

Official Name

English

pentapiperium metilsulfate [INN]

Common Name

English

PENTAPIPERIUM METHYLSULFATE [USAN]

Common Name

English

PENTAPIPERIUM METILSULFATE [MART.]

Common Name

English

4-Hydroxy-1,1-dimethylpiperidinium methyl sulfate 3-methyl-2-phenylvalerate

Systematic Name

English

PENTAPIPERIDE METHYLSULFATE

Common Name

English

PENTAPIPERIDE METHYLSULPHATE

Common Name

English

PENTAPIPERIDE METHOSULFATE [MI]

Common Name

English

Pentapiperium metilsulfate [WHO-DD]

Common Name

English

PIPERIDINIUM, 1,1-DIMETHYL-4-((3-METHYL-1-OXO-2-PHENYLPENTYL)OXY)-, METHYL SULFATE

Common Name

English

PENTAPIPERIUM METILSULFATE

Official Name

English

PENTAPIPERIDE METILSULFATE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID80998133