[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] 5-bromanyl-2-oxidanyl-benzoate Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl] 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid [2-(2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylanilino)-2-oxoethyl] 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid [2-keto-2-(o-toluidino)ethyl] ester Formula: C16H14BrNO4 MolecularWeight: 364.19066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)COC(=O)C2=C(C=CC(=C2)Br)O

Isomeric SMILES

CC1=CC=CC=C1NC(=O)COC(=O)C2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C16H14BrNO4/c1-10-4-2-3-5-13(10)18-15(20)9-22-16(21)12-8-11(17)6-7-14(12)19/h2-8,19H,9H2,1H3,(H,18,20)