2-butyl-3-(3-chlorophenyl)-4-piperidin-1-ylcarbonyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-butyl-3-(3-chlorophenyl)-4-piperidin-1-ylcarbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 2-butyl-3-(3-chlorophenyl)-4-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-1-one CAS Name: 2-butyl-3-(3-chlorophenyl)-4-[oxo(1-piperidinyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-butyl-3-(3-chlorophenyl)-4-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 2-butyl-3-(3-chlorophenyl)-4-(piperidine-1-carbonyl)-3,4-dihydroisocarbostyril Formula: C25H29ClN2O2 MolecularWeight: 424.96296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCCCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCCCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H29ClN2O2/c1-2-3-16-28-23(18-10-9-11-19(26)17-18)22(25(30)27-14-7-4-8-15-27)20-12-5-6-13-21(20)24(28)29/h5-6,9-13,17,22-23H,2-4,7-8,14-16H2,1H3