6-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one

Systemtic Name: 6-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one Openeye Name: 1-benzyl-6-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2-one CAS Name: 6-[4-[(3,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one IUPAC Name: 1-benzyl-6-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2-one Traditional Name: 1-benzyl-6-[4-(3,4-dichlorobenzoyl)piperazino]-3,4-dihydrocarbostyril Formula: C27H25Cl2N3O2 MolecularWeight: 494.4123

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C2=C1C=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)Cl)Cl)CC5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N(C2=C1C=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)Cl)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C27H25Cl2N3O2/c28-23-9-6-21(17-24(23)29)27(34)31-14-12-30(13-15-31)22-8-10-25-20(16-22)7-11-26(33)32(25)18-19-4-2-1-3-5-19/h1-6,8-10,16-17H,7,11-15,18H2