(E)-2-benzamido-3-[5-[2-(hydroxymethyl)phenyl]thiophen-2-yl]prop-2-enoic acid

Systemtic Name: (E)-2-benzamido-3-[5-[2-(hydroxymethyl)phenyl]thiophen-2-yl]prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-[5-[2-(hydroxymethyl)phenyl]-2-thienyl]prop-2-enoic acid CAS Name: (E)-2-benzamido-3-[5-[2-(hydroxymethyl)phenyl]-2-thiophenyl]-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-[5-[2-(hydroxymethyl)phenyl]thiophen-2-yl]prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-[5-(2-methylolphenyl)-2-thienyl]acrylic acid Formula: C21H17NO4S MolecularWeight: 379.42898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(S2)C3=CC=CC=C3CO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=C(S2)C3=CC=CC=C3CO)/C(=O)O

InChI

InChI=1S/C21H17NO4S/c23-13-15-8-4-5-9-17(15)19-11-10-16(27-19)12-18(21(25)26)22-20(24)14-6-2-1-3-7-14/h1-12,23H,13H2,(H,22,24)(H,25,26)/b18-12+