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

Details

Stereochemistry RACEMIC
Molecular Formula C15H22N2O.ClH
Molecular Weight 282.809
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIQUINDONE HYDROCHLORIDE ANHYDROUS

SMILES

Cl.[H][C@@]12CCN(C)C[C@@]1([H])C(=O)C3=C(C2)NC(C)=C3CC

InChI

InChIKey=SFILABVANJHLDH-XOZOLZJESA-N
InChI=1S/C15H22N2O.ClH/c1-4-11-9(2)16-13-7-10-5-6-17(3)8-12(10)15(18)14(11)13;/h10,12,16H,4-8H2,1-3H3;1H/t10-,12+;/m0./s1

HIDE SMILES / InChI

Approval Year

Unknown
86413
Name Type Language
PIQUINDONE HYDROCHLORIDE ANHYDROUS
Common Name English
(±)-PIQUINDONE HYDROCHLORIDE ANHYDROUS
Common Name English
4H-PYRROLO(2,3-G)ISOQUINOLIN-4-ONE, 3-ETHYL-1,4A,5,6,7,8,8A,9-OCTAHYDRO-2,6-DIMETHYL-, HYDROCHLORIDE (1:1), (4AR,8AR)-REL-
Common Name English
(±)-TRANS-3-ETHYL-1,4A,5,6,7,8,8A,9-OCTAHYDRO-2,6-DIMETHYL-4H-PYRROLO(2,3-G)ISOQUINOLIN-4-ONE MONOHYDROCHLORIDE
Common Name English
Code System Code Type Description
PUBCHEM
15572931
Created by admin on Sat Dec 16 04:49:37 UTC 2023 , Edited by admin on Sat Dec 16 04:49:37 UTC 2023
PRIMARY
FDA UNII
U94K2VY961
Created by admin on Sat Dec 16 04:49:37 UTC 2023 , Edited by admin on Sat Dec 16 04:49:37 UTC 2023
PRIMARY
CAS
75689-38-2
Created by admin on Sat Dec 16 04:49:37 UTC 2023 , Edited by admin on Sat Dec 16 04:49:37 UTC 2023
PRIMARY
EPA CompTox
DTXSID70997115
Created by admin on Sat Dec 16 04:49:37 UTC 2023 , Edited by admin on Sat Dec 16 04:49:37 UTC 2023
PRIMARY
ACTIVE MOIETY
Structure of PIQUINDONE
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966