5-[[2-[[(E)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]amino]phenyl]sulfamoyl]-2-methyl-benzoic acid

Systemtic Name: 5-[[2-[[(E)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]amino]phenyl]sulfamoyl]-2-methyl-benzoic acid Openeye Name: 5-[[2-[[(E)-2-cyano-3-ethoxy-3-oxo-prop-1-enyl]amino]phenyl]sulfamoyl]-2-methyl-benzoic acid CAS Name: 5-[[2-[[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]amino]phenyl]sulfamoyl]-2-methylbenzoic acid IUPAC Name: 5-[[2-[[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]amino]phenyl]sulfamoyl]-2-methylbenzoic acid Traditional Name: 5-[[2-[[(E)-2-cyano-3-ethoxy-3-keto-prop-1-enyl]amino]phenyl]sulfamoyl]-2-methyl-benzoic acid Formula: C20H19N3O6S MolecularWeight: 429.44636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)O)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)O)/C#N

InChI

InChI=1S/C20H19N3O6S/c1-3-29-20(26)14(11-21)12-22-17-6-4-5-7-18(17)23-30(27,28)15-9-8-13(2)16(10-15)19(24)25/h4-10,12,22-23H,3H2,1-2H3,(H,24,25)/b14-12+