N-[(E)-[4-[ethyl-(phenylmethyl)amino]phenyl]methylideneamino]-3-nitro-benzenesulfonamide

Systemtic Name: N-[(E)-[4-[ethyl-(phenylmethyl)amino]phenyl]methylideneamino]-3-nitro-benzenesulfonamide Openeye Name: N-[(E)-[4-[benzyl(ethyl)amino]phenyl]methyleneamino]-3-nitro-benzenesulfonamide CAS Name: N-[(E)-[4-[ethyl-(phenylmethyl)amino]phenyl]methylideneamino]-3-nitrobenzenesulfonamide IUPAC Name: N-[(E)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-3-nitrobenzenesulfonamide Traditional Name: N-[(E)-[4-[benzyl(ethyl)amino]benzylidene]amino]-3-nitro-benzenesulfonamide Formula: C22H22N4O4S MolecularWeight: 438.49948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C=NNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)/C=N/NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4S/c1-2-25(17-19-7-4-3-5-8-19)20-13-11-18(12-14-20)16-23-24-31(29,30)22-10-6-9-21(15-22)26(27)28/h3-16,24H,2,17H2,1H3/b23-16+