[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-quinolin-8-ylsulfanylethanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-quinolin-8-ylsulfanylethanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-(8-quinolylsulfanyl)acetate CAS Name: 2-(8-quinolinylthio)acetic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-quinolin-8-ylsulfanylacetate Traditional Name: 2-(8-quinolylthio)acetic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C19H14BrNO3S MolecularWeight: 416.28836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14BrNO3S/c20-15-8-6-13(7-9-15)16(22)11-24-18(23)12-25-17-5-1-3-14-4-2-10-21-19(14)17/h1-10H,11-12H2