[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] (E)-3-(5-bromanylthiophen-2-yl)prop-2-enoate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] (E)-3-(5-bromanylthiophen-2-yl)prop-2-enoate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] (E)-3-(5-bromo-2-thienyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-thiophenyl)-2-propenoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] (E)-3-(5-bromothiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-thienyl)acrylic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C16H13BrO4S MolecularWeight: 381.24102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)COC(=O)C=CC2=CC=C(S2)Br

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)COC(=O)/C=C/C2=CC=C(S2)Br

InChI

InChI=1S/C16H13BrO4S/c1-20-12-4-2-11(3-5-12)14(18)10-21-16(19)9-7-13-6-8-15(17)22-13/h2-9H,10H2,1H3/b9-7+