(E)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]but-2-en-1-one Openeye Name: (E)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]but-2-en-1-one CAS Name: (E)-1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]but-2-en-1-one Traditional Name: (E)-1-[4-(3-nitrophenyl)sulfonylpiperazino]but-2-en-1-one Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

C/C=C/C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O5S/c1-2-4-14(18)15-7-9-16(10-8-15)23(21,22)13-6-3-5-12(11-13)17(19)20/h2-6,11H,7-10H2,1H3/b4-2+