(E)-4-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-4-oxo-but-2-enoate CAS Name: (E)-4-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-4-oxo-2-butenoate IUPAC Name: (E)-4-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-4-oxobut-2-enoate Traditional Name: (E)-4-keto-4-[4-(3-nitrophenyl)sulfonylpiperazino]but-2-enoate Formula: C14H14N3O7S- MolecularWeight: 368.34186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O7S/c18-13(4-5-14(19)20)15-6-8-16(9-7-15)25(23,24)12-3-1-2-11(10-12)17(21)22/h1-5,10H,6-9H2,(H,19,20)/p-1/b5-4+