4-[(E)-3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]-N-propyl-benzenesulfonamide

Systemtic Name: 4-[(E)-3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]-N-propyl-benzenesulfonamide Openeye Name: 4-[(E)-3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxo-prop-1-enyl]-N-propyl-benzenesulfonamide CAS Name: 4-[(E)-3-[4-(4-nitrophenyl)-1-piperazinyl]-3-oxoprop-1-enyl]-N-propylbenzenesulfonamide IUPAC Name: 4-[(E)-3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxoprop-1-enyl]-N-propylbenzenesulfonamide Traditional Name: 4-[(E)-3-keto-3-[4-(4-nitrophenyl)piperazino]prop-1-enyl]-N-propyl-benzenesulfonamide Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O5S/c1-2-13-23-32(30,31)21-10-3-18(4-11-21)5-12-22(27)25-16-14-24(15-17-25)19-6-8-20(9-7-19)26(28)29/h3-12,23H,2,13-17H2,1H3/b12-5+