2-(4-nitroimidazol-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-nitroimidazol-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-nitroimidazol-1-yl)-1-[4-[(E)-styryl]sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(4-nitro-1-imidazolyl)-1-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(4-nitroimidazol-1-yl)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(4-nitroimidazol-1-yl)-1-[4-[(E)-styryl]sulfonylpiperazino]ethanone Formula: C17H19N5O5S MolecularWeight: 405.42826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=C(N=C2)[N+](=O)[O-])S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=C(N=C2)[N+](=O)[O-])S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C17H19N5O5S/c23-17(13-19-12-16(18-14-19)22(24)25)20-7-9-21(10-8-20)28(26,27)11-6-15-4-2-1-3-5-15/h1-6,11-12,14H,7-10,13H2/b11-6+