U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H26N2O3
Molecular Weight 378.4641
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SOLIFENACIN N1-OXIDE

SMILES

[O-][N+]12CCC(CC1)[C@H](C2)OC(=O)N3CCC4=CC=CC=C4[C@@H]3C5=CC=CC=C5

InChI

InChIKey=PNHAPLMCCXMFAI-QYYKVDRLSA-N
InChI=1S/C23H26N2O3/c26-23(28-21-16-25(27)14-11-18(21)12-15-25)24-13-10-17-6-4-5-9-20(17)22(24)19-7-2-1-3-8-19/h1-9,18,21-22H,10-16H2/t18?,21-,22-,25?/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H26N2O3
Molecular Weight 378.4641
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 07:58:56 GMT 2023
Edited
by admin
on Sat Dec 16 07:58:56 GMT 2023
Record UNII
67V0THE6SU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SOLIFENACIN N1-OXIDE
Common Name English
SOLIFENACIN (M2)
Common Name English
2(1H)-ISOQUINOLINECARBOXYLIC ACID, 3,4-DIHYDRO-1-PHENYL-, (3R)-1-OXIDO-1-AZABICYCLO(2.2.2)OCT-3-YL ESTER, (1S)-
Systematic Name English
Code System Code Type Description
CAS
180272-28-0
Created by admin on Sat Dec 16 07:58:56 GMT 2023 , Edited by admin on Sat Dec 16 07:58:56 GMT 2023
PRIMARY
PUBCHEM
29987059
Created by admin on Sat Dec 16 07:58:56 GMT 2023 , Edited by admin on Sat Dec 16 07:58:56 GMT 2023
PRIMARY
FDA UNII
67V0THE6SU
Created by admin on Sat Dec 16 07:58:56 GMT 2023 , Edited by admin on Sat Dec 16 07:58:56 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE INACTIVE
major in urine
MAJOR
PLASMA; URINE