(E)-2-benzamido-3-[4-(2-methylsulfanylphenoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-2-benzamido-3-[4-(2-methylsulfanylphenoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-[4-(2-methylsulfanylphenoxy)phenyl]prop-2-enoic acid CAS Name: (E)-2-benzamido-3-[4-[2-(methylthio)phenoxy]phenyl]-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-[4-(2-methylsulfanylphenoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-[4-[2-(methylthio)phenoxy]phenyl]acrylic acid Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1OC2=CC=C(C=C2)C=C(C(=O)O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC=C1OC2=CC=C(C=C2)/C=C(\C(=O)O)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H19NO4S/c1-29-21-10-6-5-9-20(21)28-18-13-11-16(12-14-18)15-19(23(26)27)24-22(25)17-7-3-2-4-8-17/h2-15H,1H3,(H,24,25)(H,26,27)/b19-15+