[4-chloranyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 3-methoxybenzoate

Systemtic Name: [4-chloranyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 3-methoxybenzoate Openeye Name: [4-chloro-2-[(E)-3-(2-thienyl)prop-2-enoyl]phenyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [4-chloro-2-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]phenyl] ester IUPAC Name: [4-chloro-2-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [4-chloro-2-[(E)-3-(2-thienyl)acryloyl]phenyl] ester Formula: C21H15ClO4S MolecularWeight: 398.8594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Cl)C(=O)C=CC3=CC=CS3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Cl)C(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C21H15ClO4S/c1-25-16-5-2-4-14(12-16)21(24)26-20-10-7-15(22)13-18(20)19(23)9-8-17-6-3-11-27-17/h2-13H,1H3/b9-8+