2-[4-(2-nitrophenyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(2-nitrophenyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(2-nitrophenyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-(2-nitrophenyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(2-nitrophenyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(2-nitrophenyl)piperazino]sulfonylbenzonitrile Formula: C17H16N4O4S MolecularWeight: 372.39834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C17H16N4O4S/c18-13-14-5-1-4-8-17(14)26(24,25)20-11-9-19(10-12-20)15-6-2-3-7-16(15)21(22)23/h1-8H,9-12H2