4-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]-1-(2-dimethylaminoethyl)-6-methyl-3-nitro-quinolin-2-one

Systemtic Name: 4-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]-1-(2-dimethylaminoethyl)-6-methyl-3-nitro-quinolin-2-one Openeye Name: 4-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-1-(2-dimethylaminoethyl)-6-methyl-3-nitro-quinolin-2-one CAS Name: 4-[4-[(3,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-1-(2-dimethylaminoethyl)-6-methyl-3-nitro-2-quinolinone IUPAC Name: 4-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-1-(2-dimethylaminoethyl)-6-methyl-3-nitroquinolin-2-one Traditional Name: 4-[4-(3,4-dichlorobenzoyl)piperazino]-1-(2-dimethylaminoethyl)-6-methyl-3-nitro-carbostyril Formula: C25H27Cl2N5O4 MolecularWeight: 532.41898

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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)Cl)[N+](=O)[O-])CCN(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H27Cl2N5O4/c1-16-4-7-21-18(14-16)22(23(32(35)36)25(34)31(21)13-8-28(2)3)29-9-11-30(12-10-29)24(33)17-5-6-19(26)20(27)15-17/h4-7,14-15H,8-13H2,1-3H3