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

Systemtic Name: 6-[4-(4-butoxyphenyl)carbonylpiperazin-1-yl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one Openeye Name: 1-benzyl-6-[4-(4-butoxybenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2-one CAS Name: 6-[4-[(4-butoxyphenyl)-oxomethyl]-1-piperazinyl]-1-(phenylmethyl)-3,4-dihydroquinolin-2-one IUPAC Name: 1-benzyl-6-[4-(4-butoxybenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2-one Traditional Name: 1-benzyl-6-[4-(4-butoxybenzoyl)piperazino]-3,4-dihydrocarbostyril Formula: C31H35N3O3 MolecularWeight: 497.6279

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)CC5=CC=CC=C5

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)N(C(=O)CC4)CC5=CC=CC=C5

InChI

InChI=1S/C31H35N3O3/c1-2-3-21-37-28-13-9-25(10-14-28)31(36)33-19-17-32(18-20-33)27-12-15-29-26(22-27)11-16-30(35)34(29)23-24-7-5-4-6-8-24/h4-10,12-15,22H,2-3,11,16-21,23H2,1H3