methyl 4-[(E)-3-(2,5-dimethylthiophen-3-yl)-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-(2,5-dimethylthiophen-3-yl)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(2,5-dimethyl-3-thienyl)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(2,5-dimethyl-3-thiophenyl)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(2,5-dimethylthiophen-3-yl)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(2,5-dimethyl-3-thienyl)-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C17H16O3S MolecularWeight: 300.37214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)C=CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)/C=C/C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H16O3S/c1-11-10-15(12(2)21-11)16(18)9-6-13-4-7-14(8-5-13)17(19)20-3/h4-10H,1-3H3/b9-6+