methyl 4-[[(E)-3-[4-(propylsulfamoyl)phenyl]prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 4-[[(E)-3-[4-(propylsulfamoyl)phenyl]prop-2-enoyl]amino]benzoate Openeye Name: methyl 4-[[(E)-3-[4-(propylsulfamoyl)phenyl]prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-1-oxo-3-[4-(propylsulfamoyl)phenyl]prop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-3-[4-(propylsulfamoyl)phenyl]prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-[4-(propylsulfamoyl)phenyl]acryloyl]amino]benzoic acid methyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H22N2O5S/c1-3-14-21-28(25,26)18-11-4-15(5-12-18)6-13-19(23)22-17-9-7-16(8-10-17)20(24)27-2/h4-13,21H,3,14H2,1-2H3,(H,22,23)/b13-6+