N-(2-cyanoethyl)-4-(4-nitrophenyl)-N-phenethyl-benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-(4-nitrophenyl)-N-phenethyl-benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-4-(4-nitrophenyl)-N-phenethyl-benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-(4-nitrophenyl)-N-phenethylbenzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-4-(4-nitrophenyl)-N-phenethylbenzenesulfonamide Traditional Name: N-(2-cyanoethyl)-4-(4-nitrophenyl)-N-phenethyl-benzenesulfonamide Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CCC#N)S(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN(CCC#N)S(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O4S/c24-16-4-17-25(18-15-19-5-2-1-3-6-19)31(29,30)23-13-9-21(10-14-23)20-7-11-22(12-8-20)26(27)28/h1-3,5-14H,4,15,17-18H2