[4-[(E)-2-cyano-3-oxidanylidene-3-[(4-sulfamoylphenyl)amino]prop-1-enyl]-2-methoxy-phenyl] propanoate

Systemtic Name: [4-[(E)-2-cyano-3-oxidanylidene-3-[(4-sulfamoylphenyl)amino]prop-1-enyl]-2-methoxy-phenyl] propanoate Openeye Name: [4-[(E)-2-cyano-3-oxo-3-(4-sulfamoylanilino)prop-1-enyl]-2-methoxy-phenyl] propanoate CAS Name: propanoic acid [4-[(E)-2-cyano-3-oxo-3-(4-sulfamoylanilino)prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-oxo-3-(4-sulfamoylanilino)prop-1-enyl]-2-methoxyphenyl] propanoate Traditional Name: propionic acid [4-[(E)-2-cyano-3-keto-3-(4-sulfamoylanilino)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C20H19N3O6S MolecularWeight: 429.44636

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)OC

Isomeric SMILES

CCC(=O)OC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)OC

InChI

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