3-[4-[[4-(pyridin-4-ylmethyl)phenyl]sulfamoyl]phenyl]prop-2-enoic acid

Systemtic Name: 3-[4-[[4-(pyridin-4-ylmethyl)phenyl]sulfamoyl]phenyl]prop-2-enoic acid Openeye Name: 3-[4-[[4-(4-pyridylmethyl)phenyl]sulfamoyl]phenyl]prop-2-enoic acid CAS Name: 3-[4-[[4-(pyridin-4-ylmethyl)phenyl]sulfamoyl]phenyl]-2-propenoic acid IUPAC Name: 3-[4-[[4-(pyridin-4-ylmethyl)phenyl]sulfamoyl]phenyl]prop-2-enoic acid Traditional Name: 3-[4-[[4-(4-pyridylmethyl)phenyl]sulfamoyl]phenyl]acrylic acid Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=NC=C2)NS(=O)(=O)C3=CC=C(C=C3)C=CC(=O)O

Isomeric SMILES

C1=CC(=CC=C1CC2=CC=NC=C2)NS(=O)(=O)C3=CC=C(C=C3)C=CC(=O)O

InChI

InChI=1S/C21H18N2O4S/c24-21(25)10-5-16-3-8-20(9-4-16)28(26,27)23-19-6-1-17(2-7-19)15-18-11-13-22-14-12-18/h1-14,23H,15H2,(H,24,25)