[2-[[2,4-bis(bromanyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-methoxy-4-methylsulfanyl-benzoate

Systemtic Name: [2-[[2,4-bis(bromanyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-methoxy-4-methylsulfanyl-benzoate Openeye Name: [2-(2,4-dibromoanilino)-2-oxo-ethyl] 2-methoxy-4-methylsulfanyl-benzoate CAS Name: 2-methoxy-4-(methylthio)benzoic acid [2-(2,4-dibromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dibromoanilino)-2-oxoethyl] 2-methoxy-4-methylsulfanylbenzoate Traditional Name: 2-methoxy-4-(methylthio)benzoic acid [2-(2,4-dibromoanilino)-2-keto-ethyl] ester Formula: C17H15Br2NO4S MolecularWeight: 489.1783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)OCC(=O)NC2=C(C=C(C=C2)Br)Br

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)OCC(=O)NC2=C(C=C(C=C2)Br)Br

InChI

InChI=1S/C17H15Br2NO4S/c1-23-15-8-11(25-2)4-5-12(15)17(22)24-9-16(21)20-14-6-3-10(18)7-13(14)19/h3-8H,9H2,1-2H3,(H,20,21)