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

Systemtic Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-phenyl-methanone CAS Name: [4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]-phenylmethanone IUPAC Name: [4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]-phenylmethanone Traditional Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]-phenyl-methanone Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O6S/c1-27-17-8-7-15(13-16(17)21(23)24)28(25,26)20-11-9-19(10-12-20)18(22)14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3