N-methyl-3-nitro-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]benzenesulfonamide

Systemtic Name: N-methyl-3-nitro-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]benzenesulfonamide Openeye Name: 4-[4-[(E)-cinnamyl]piperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide CAS Name: N-methyl-3-nitro-4-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]benzenesulfonamide IUPAC Name: N-methyl-3-nitro-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]benzenesulfonamide Traditional Name: 4-[4-[(E)-cinnamyl]piperazino]-N-methyl-3-nitro-benzenesulfonamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC=CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C/C=C/C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O4S/c1-21-29(27,28)18-9-10-19(20(16-18)24(25)26)23-14-12-22(13-15-23)11-5-8-17-6-3-2-4-7-17/h2-10,16,21H,11-15H2,1H3/b8-5+