(E)-2-[3,4-bis(oxidanyl)phenyl]-1-cyano-N-(3-phenylpropyl)ethenesulfonamide

Systemtic Name: (E)-2-[3,4-bis(oxidanyl)phenyl]-1-cyano-N-(3-phenylpropyl)ethenesulfonamide Openeye Name: (E)-1-cyano-2-(3,4-dihydroxyphenyl)-N-(3-phenylpropyl)ethenesulfonamide CAS Name: (E)-1-cyano-2-(3,4-dihydroxyphenyl)-N-(3-phenylpropyl)ethenesulfonamide IUPAC Name: (E)-1-cyano-2-(3,4-dihydroxyphenyl)-N-(3-phenylpropyl)ethenesulfonamide Traditional Name: (E)-1-cyano-2-(3,4-dihydroxyphenyl)-N-(3-phenylpropyl)ethenesulfonamide Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNS(=O)(=O)C(=CC2=CC(=C(C=C2)O)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCCNS(=O)(=O)/C(=C/C2=CC(=C(C=C2)O)O)/C#N

InChI

InChI=1S/C18H18N2O4S/c19-13-16(11-15-8-9-17(21)18(22)12-15)25(23,24)20-10-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12,20-22H,4,7,10H2/b16-11+