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Details

Stereochemistry ACHIRAL
Molecular Formula C26H28N3.Cl.2H2O
Molecular Weight 454.004
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of PYRVINIUM CHLORIDE DIHYDRATE

SMILES

O.O.[Cl-].CN(C)C1=CC2=C(C=C1)[N+](C)=C(\C=C\C3=C(C)N(C(C)=C3)C4=CC=CC=C4)C=C2

InChI

InChIKey=BSFRPKBHTPMTGV-UHFFFAOYSA-M
InChI=1S/C26H28N3.ClH.2H2O/c1-19-17-21(20(2)29(19)24-9-7-6-8-10-24)11-13-23-14-12-22-18-25(27(3)4)15-16-26(22)28(23)5;;;/h6-18H,1-5H3;1H;2*1H2/q+1;;;/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
PYRVINIUM CHLORIDE DIHYDRATE
Common Name English
QUINOLINIUM, 6-(DIMETHYLAMINO)-2-(2-(2,5-DIMETHYL-1-PHENYL-1H-PYRROL-3-YL)ETHENYL)-1-METHYL-, CHLORIDE, HYDRATE (1:1:2)
Systematic Name English
Code System Code Type Description
PUBCHEM
12314839
Created by admin on Fri Dec 15 15:26:16 UTC 2023 , Edited by admin on Fri Dec 15 15:26:16 UTC 2023
PRIMARY
FDA UNII
3XL8T5I39L
Created by admin on Fri Dec 15 15:26:16 UTC 2023 , Edited by admin on Fri Dec 15 15:26:16 UTC 2023
PRIMARY
CAS
6151-23-1
Created by admin on Fri Dec 15 15:26:16 UTC 2023 , Edited by admin on Fri Dec 15 15:26:16 UTC 2023
PRIMARY