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

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)-[4-[(E)-styryl]sulfonylpiperazin-1-yl]methanone CAS Name: (4,5-dimethoxy-2-nitrophenyl)-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (4,5-dimethoxy-2-nitro-phenyl)-[4-[(E)-styryl]sulfonylpiperazino]methanone Formula: C21H23N3O7S MolecularWeight: 461.48822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O7S/c1-30-19-14-17(18(24(26)27)15-20(19)31-2)21(25)22-9-11-23(12-10-22)32(28,29)13-8-16-6-4-3-5-7-16/h3-8,13-15H,9-12H2,1-2H3/b13-8+