[4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 2,6-dimethoxybenzoate

Systemtic Name: [4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 2,6-dimethoxybenzoate Openeye Name: [4-[(E)-3-(2-thienyl)prop-2-enoyl]phenyl] 2,6-dimethoxybenzoate CAS Name: 2,6-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] 2,6-dimethoxybenzoate Traditional Name: 2,6-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(=CC=C1)OC)C(=O)OC2=CC=C(C=C2)C(=O)C=CC3=CC=CS3

Isomeric SMILES

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

InChI

InChI=1S/C22H18O5S/c1-25-19-6-3-7-20(26-2)21(19)22(24)27-16-10-8-15(9-11-16)18(23)13-12-17-5-4-14-28-17/h3-14H,1-2H3/b13-12+