N-[2-cyano-1-(4-nitrophenyl)prop-2-enyl]-N-[(2E)-penta-2,4-dienyl]benzenesulfonamide

Systemtic Name: N-[2-cyano-1-(4-nitrophenyl)prop-2-enyl]-N-[(2E)-penta-2,4-dienyl]benzenesulfonamide Openeye Name: N-[2-cyano-1-(4-nitrophenyl)allyl]-N-[(2E)-penta-2,4-dienyl]benzenesulfonamide CAS Name: N-[2-cyano-1-(4-nitrophenyl)prop-2-enyl]-N-[(2E)-penta-2,4-dienyl]benzenesulfonamide IUPAC Name: N-[2-cyano-1-(4-nitrophenyl)prop-2-enyl]-N-[(2E)-penta-2,4-dienyl]benzenesulfonamide Traditional Name: N-[2-cyano-1-(4-nitrophenyl)allyl]-N-[(2E)-penta-2,4-dienyl]benzenesulfonamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=CCN(C(C1=CC=C(C=C1)[N+](=O)[O-])C(=C)C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C=C/C=C/CN(C(C1=CC=C(C=C1)[N+](=O)[O-])C(=C)C#N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H19N3O4S/c1-3-4-8-15-23(29(27,28)20-9-6-5-7-10-20)21(17(2)16-22)18-11-13-19(14-12-18)24(25)26/h3-14,21H,1-2,15H2/b8-4+