[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(4,5-dimethoxy-2-nitro-phenyl)methanone

Systemtic Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(4,5-dimethoxy-2-nitro-phenyl)methanone Openeye Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(4,5-dimethoxy-2-nitro-phenyl)methanone CAS Name: [4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-(4,5-dimethoxy-2-nitrophenyl)methanone IUPAC Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(4,5-dimethoxy-2-nitrophenyl)methanone Traditional Name: [4-(4-chlorophenyl)sulfonylpiperazino]-(4,5-dimethoxy-2-nitro-phenyl)methanone Formula: C19H20ClN3O7S MolecularWeight: 469.896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C19H20ClN3O7S/c1-29-17-11-15(16(23(25)26)12-18(17)30-2)19(24)21-7-9-22(10-8-21)31(27,28)14-5-3-13(20)4-6-14/h3-6,11-12H,7-10H2,1-2H3