4-[(E)-3-(4-methoxy-2-thiophen-2-yl-phenyl)prop-2-enoyl]benzoic acid

Systemtic Name: 4-[(E)-3-(4-methoxy-2-thiophen-2-yl-phenyl)prop-2-enoyl]benzoic acid Openeye Name: 4-[(E)-3-[4-methoxy-2-(2-thienyl)phenyl]prop-2-enoyl]benzoic acid CAS Name: 4-[(E)-3-(4-methoxy-2-thiophen-2-ylphenyl)-1-oxoprop-2-enyl]benzoic acid IUPAC Name: 4-[(E)-3-(4-methoxy-2-thiophen-2-ylphenyl)prop-2-enoyl]benzoic acid Traditional Name: 4-[(E)-3-[4-methoxy-2-(2-thienyl)phenyl]acryloyl]benzoic acid Formula: C21H16O4S MolecularWeight: 364.41434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=CC(=O)C2=CC=C(C=C2)C(=O)O)C3=CC=CS3

Isomeric SMILES

COC1=CC(=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)C(=O)O)C3=CC=CS3

InChI

InChI=1S/C21H16O4S/c1-25-17-10-8-14(18(13-17)20-3-2-12-26-20)9-11-19(22)15-4-6-16(7-5-15)21(23)24/h2-13H,1H3,(H,23,24)/b11-9+