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Details

Stereochemistry ACHIRAL
Molecular Formula C21H18NO4.CH3O4S
Molecular Weight 459.469
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NITIDINE METHYL SULFATE

SMILES

COS([O-])(=O)=O.COC1=C(OC)C=C2C(=C1)C=[N+](C)C3=C2C=CC4=C3C=C5OCOC5=C4

InChI

InChIKey=RQQPNGIYTFBRBS-UHFFFAOYSA-M
InChI=1S/C21H18NO4.CH4O4S/c1-22-10-13-7-17(23-2)18(24-3)8-15(13)14-5-4-12-6-19-20(26-11-25-19)9-16(12)21(14)22;1-5-6(2,3)4/h4-10H,11H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
NITIDINE METHYL SULFATE
Common Name English
2,3-DIMETHOXY-12-METHYL(1,3)BENZODIOXOLO(5,6-C)PHENANTHRIDINIUM METHYL SULFATE
Systematic Name English
(1,3)BENZODIOXOLO(5,6-C)PHENANTHRIDINIUM, 2,3-DIMETHOXY-12-METHYL-, METHYL SULFATE (1:1)
Systematic Name English
(1,3)BENZODIOXOLO(5,6-C)PHENANTHRIDINIUM, 2,3-DIMETHOXY-12-METHYL-, METHYL SULFATE
Systematic Name English
NSC-160842
Code English
Code System Code Type Description
CAS
41349-35-3
Created by admin on Sat Dec 16 08:43:51 UTC 2023 , Edited by admin on Sat Dec 16 08:43:51 UTC 2023
PRIMARY
NSC
160842
Created by admin on Sat Dec 16 08:43:51 UTC 2023 , Edited by admin on Sat Dec 16 08:43:51 UTC 2023
PRIMARY
PUBCHEM
38846
Created by admin on Sat Dec 16 08:43:51 UTC 2023 , Edited by admin on Sat Dec 16 08:43:51 UTC 2023
PRIMARY
FDA UNII
7S3U26FNX3
Created by admin on Sat Dec 16 08:43:51 UTC 2023 , Edited by admin on Sat Dec 16 08:43:51 UTC 2023
PRIMARY
EPA CompTox
DTXSID50194302
Created by admin on Sat Dec 16 08:43:51 UTC 2023 , Edited by admin on Sat Dec 16 08:43:51 UTC 2023
PRIMARY