6-[2-[4-(phenylmethyl)piperidin-1-yl]butanoyl]-1H-quinolin-2-one hydrochloride

Systemtic Name: 6-[2-[4-(phenylmethyl)piperidin-1-yl]butanoyl]-1H-quinolin-2-one hydrochloride Openeye Name: 6-[2-(4-benzyl-1-piperidyl)butanoyl]-1H-quinolin-2-one hydrochloride CAS Name: 6-[1-oxo-2-[4-(phenylmethyl)-1-piperidinyl]butyl]-1H-quinolin-2-one hydrochloride IUPAC Name: 6-[2-(4-benzylpiperidin-1-yl)butanoyl]-1H-quinolin-2-one hydrochloride Traditional Name: 6-[2-(4-benzylpiperidino)butanoyl]carbostyril hydrochloride Formula: C25H29ClN2O2 MolecularWeight: 424.96296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC2=C(C=C1)NC(=O)C=C2)N3CCC(CC3)CC4=CC=CC=C4.Cl

Isomeric SMILES

CCC(C(=O)C1=CC2=C(C=C1)NC(=O)C=C2)N3CCC(CC3)CC4=CC=CC=C4.Cl

InChI

InChI=1S/C25H28N2O2.ClH/c1-2-23(25(29)21-8-10-22-20(17-21)9-11-24(28)26-22)27-14-12-19(13-15-27)16-18-6-4-3-5-7-18;/h3-11,17,19,23H,2,12-16H2,1H3,(H,26,28);1H