[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-(4-methoxy-2-oxidanyl-phenyl)methanone

Systemtic Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-(4-methoxy-2-oxidanyl-phenyl)methanone Openeye Name: (2-hydroxy-4-methoxy-phenyl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-hydroxy-4-methoxyphenyl)-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-hydroxy-4-methoxyphenyl)-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2-hydroxy-4-methoxy-phenyl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methanone Formula: C19H21N3O8S MolecularWeight: 451.45034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O8S/c1-29-13-3-5-15(17(23)11-13)19(24)20-7-9-21(10-8-20)31(27,28)14-4-6-18(30-2)16(12-14)22(25)26/h3-6,11-12,23H,7-10H2,1-2H3