N-(2-cyanoethyl)-N-(4-ethoxyphenyl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-N-(4-ethoxyphenyl)-2-nitro-benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-N-(4-ethoxyphenyl)-2-nitro-benzenesulfonamide CAS Name: N-(2-cyanoethyl)-N-(4-ethoxyphenyl)-2-nitrobenzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-N-(4-ethoxyphenyl)-2-nitrobenzenesulfonamide Traditional Name: N-(2-cyanoethyl)-2-nitro-N-p-phenetyl-benzenesulfonamide Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CCC#N)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CCC#N)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5S/c1-2-25-15-10-8-14(9-11-15)19(13-5-12-18)26(23,24)17-7-4-3-6-16(17)20(21)22/h3-4,6-11H,2,5,13H2,1H3