4-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]-3-nitro-1-(phenylmethyl)quinolin-2-one

Systemtic Name: 4-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]-3-nitro-1-(phenylmethyl)quinolin-2-one Openeye Name: 1-benzyl-4-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-3-nitro-quinolin-2-one CAS Name: 4-[4-[(3,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-3-nitro-1-(phenylmethyl)-2-quinolinone IUPAC Name: 1-benzyl-4-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-3-nitroquinolin-2-one Traditional Name: 1-benzyl-4-[4-(3,4-dichlorobenzoyl)piperazino]-3-nitro-carbostyril Formula: C27H22Cl2N4O4 MolecularWeight: 537.39398

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(C3=CC=CC=C32)CC4=CC=CC=C4)[N+](=O)[O-])C(=O)C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(C3=CC=CC=C32)CC4=CC=CC=C4)[N+](=O)[O-])C(=O)C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C27H22Cl2N4O4/c28-21-11-10-19(16-22(21)29)26(34)31-14-12-30(13-15-31)24-20-8-4-5-9-23(20)32(27(35)25(24)33(36)37)17-18-6-2-1-3-7-18/h1-11,16H,12-15,17H2