5-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]thiophene-2-carboxylate

Systemtic Name: 5-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]thiophene-2-carboxylate Openeye Name: 5-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]thiophene-2-carboxylate CAS Name: 5-[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]-2-thiophenecarboxylate IUPAC Name: 5-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]thiophene-2-carboxylate Traditional Name: 5-[(E)-3-(3,4-dimethoxyphenyl)acryloyl]-2-thenoate Formula: C16H13O5S- MolecularWeight: 317.33642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(S2)C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(S2)C(=O)[O-])OC

InChI

InChI=1S/C16H14O5S/c1-20-12-6-4-10(9-13(12)21-2)3-5-11(17)14-7-8-15(22-14)16(18)19/h3-9H,1-2H3,(H,18,19)/p-1/b5-3+