[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C18H12BrNO3S MolecularWeight: 402.26178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C=CC(=O)OCC(=O)C3=CC=C(S3)Br)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)/C=C/C(=O)OCC(=O)C3=CC=C(S3)Br)N=CC=C2

InChI

InChI=1S/C18H12BrNO3S/c19-16-8-7-15(24-16)14(21)11-23-17(22)9-6-13-4-1-3-12-5-2-10-20-18(12)13/h1-10H,11H2/b9-6+