[2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-5-methoxy-phenyl] thiophene-2-carboxylate

Systemtic Name: [2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-5-methoxy-phenyl] thiophene-2-carboxylate Openeye Name: [2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-5-methoxy-phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]-5-methoxyphenyl] ester IUPAC Name: [2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-5-methoxyphenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [2-[(E)-3-(4-chlorophenyl)acryloyl]-5-methoxy-phenyl] ester Formula: C21H15ClO4S MolecularWeight: 398.8594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C=CC2=CC=C(C=C2)Cl)OC(=O)C3=CC=CS3

Isomeric SMILES

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

InChI

InChI=1S/C21H15ClO4S/c1-25-16-9-10-17(18(23)11-6-14-4-7-15(22)8-5-14)19(13-16)26-21(24)20-3-2-12-27-20/h2-13H,1H3/b11-6+