2-cyclopent-2-en-1-yl-1-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-cyclopent-2-en-1-yl-1-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-cyclopent-2-en-1-yl-1-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(1-cyclopent-2-enyl)-1-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-cyclopent-2-en-1-yl-1-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-cyclopent-2-en-1-yl-1-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]ethanone Formula: C18H23N3O6S MolecularWeight: 409.45672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3CCC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3CCC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O6S/c1-27-17-7-6-15(13-16(17)21(23)24)28(25,26)20-10-8-19(9-11-20)18(22)12-14-4-2-3-5-14/h2,4,6-7,13-14H,3,5,8-12H2,1H3