4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-1,6-dimethyl-3-nitro-quinolin-2-one

Systemtic Name: 4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-1,6-dimethyl-3-nitro-quinolin-2-one Openeye Name: 4-[4-(4-chlorobenzoyl)piperazin-1-yl]-1,6-dimethyl-3-nitro-quinolin-2-one CAS Name: 4-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-1,6-dimethyl-3-nitro-2-quinolinone IUPAC Name: 4-[4-(4-chlorobenzoyl)piperazin-1-yl]-1,6-dimethyl-3-nitroquinolin-2-one Traditional Name: 4-[4-(4-chlorobenzoyl)piperazino]-1,6-dimethyl-3-nitro-carbostyril Formula: C22H21ClN4O4 MolecularWeight: 440.87954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(=C2N3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C(=C2N3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C22H21ClN4O4/c1-14-3-8-18-17(13-14)19(20(27(30)31)22(29)24(18)2)25-9-11-26(12-10-25)21(28)15-4-6-16(23)7-5-15/h3-8,13H,9-12H2,1-2H3