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

Systemtic Name: methyl 4-[(E)-3-(5-bromanylthiophen-2-yl)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(5-bromo-2-thienyl)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(5-bromo-2-thiophenyl)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(5-bromothiophen-2-yl)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(5-bromo-2-thienyl)-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C15H11BrO3S MolecularWeight: 351.21504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)C2=CC=C(S2)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C15H11BrO3S/c1-19-15(18)11-5-2-10(3-6-11)4-7-12(17)13-8-9-14(16)20-13/h2-9H,1H3/b7-4+