4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-1-[3-(dimethylamino)propyl]-6-methyl-3-nitro-quinolin-2-one

Systemtic Name: 4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-1-[3-(dimethylamino)propyl]-6-methyl-3-nitro-quinolin-2-one Openeye Name: 4-[4-(4-chlorobenzoyl)piperazin-1-yl]-1-[3-(dimethylamino)propyl]-6-methyl-3-nitro-quinolin-2-one CAS Name: 4-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-1-[3-(dimethylamino)propyl]-6-methyl-3-nitro-2-quinolinone IUPAC Name: 4-[4-(4-chlorobenzoyl)piperazin-1-yl]-1-[3-(dimethylamino)propyl]-6-methyl-3-nitroquinolin-2-one Traditional Name: 4-[4-(4-chlorobenzoyl)piperazino]-1-[3-(dimethylamino)propyl]-6-methyl-3-nitro-carbostyril Formula: C26H30ClN5O4 MolecularWeight: 512.0005

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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-])CCCN(C)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-])CCCN(C)C

InChI

InChI=1S/C26H30ClN5O4/c1-18-5-10-22-21(17-18)23(24(32(35)36)26(34)31(22)12-4-11-28(2)3)29-13-15-30(16-14-29)25(33)19-6-8-20(27)9-7-19/h5-10,17H,4,11-16H2,1-3H3