6-[4-[methyl(phenethyl)amino]piperidin-1-yl]carbonyl-8-propyl-1H-quinolin-2-one hydrochloride

Systemtic Name: 6-[4-[methyl(phenethyl)amino]piperidin-1-yl]carbonyl-8-propyl-1H-quinolin-2-one hydrochloride Openeye Name: 6-[4-[methyl(phenethyl)amino]piperidine-1-carbonyl]-8-propyl-1H-quinolin-2-one hydrochloride CAS Name: 6-[[4-[methyl(phenethyl)amino]-1-piperidinyl]-oxomethyl]-8-propyl-1H-quinolin-2-one hydrochloride IUPAC Name: 6-[4-[methyl(phenethyl)amino]piperidine-1-carbonyl]-8-propyl-1H-quinolin-2-one hydrochloride Traditional Name: 6-[4-[methyl(phenethyl)amino]piperidine-1-carbonyl]-8-propyl-carbostyril hydrochloride Formula: C27H34ClN3O2 MolecularWeight: 468.03076

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC(=C1)C(=O)N3CCC(CC3)N(C)CCC4=CC=CC=C4)C=CC(=O)N2.Cl

Isomeric SMILES

CCCC1=C2C(=CC(=C1)C(=O)N3CCC(CC3)N(C)CCC4=CC=CC=C4)C=CC(=O)N2.Cl

InChI

InChI=1S/C27H33N3O2.ClH/c1-3-7-21-18-23(19-22-10-11-25(31)28-26(21)22)27(32)30-16-13-24(14-17-30)29(2)15-12-20-8-5-4-6-9-20;/h4-6,8-11,18-19,24H,3,7,12-17H2,1-2H3,(H,28,31);1H