[4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 3,4-dimethoxybenzoate

Systemtic Name: [4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 3,4-dimethoxybenzoate Openeye Name: [4-[(E)-3-(2-thienyl)prop-2-enoyl]phenyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [4-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [4-[(E)-3-(2-thienyl)acryloyl]phenyl] ester Formula: C22H18O5S MolecularWeight: 394.44032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18O5S/c1-25-20-12-7-16(14-21(20)26-2)22(24)27-17-8-5-15(6-9-17)19(23)11-10-18-4-3-13-28-18/h3-14H,1-2H3/b11-10+