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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16O4S/c1-13(20(22)14-5-7-15(8-6-14)21(23)24)16-9-10-18(25-2)17(12-16)19-4-3-11-26-19/h3-12H,1H2,2H3,(H,23,24)