[2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-bromanyl-5-methoxy-benzoate

Systemtic Name: [2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-bromanyl-5-methoxy-benzoate Openeye Name: [2-(2,5-dimethoxyanilino)-2-oxo-ethyl] 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid [2-(2,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethoxyanilino)-2-oxoethyl] 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid [2-(2,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C18H18BrNO6 MolecularWeight: 424.24262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrNO6/c1-23-11-4-6-14(19)13(8-11)18(22)26-10-17(21)20-15-9-12(24-2)5-7-16(15)25-3/h4-9H,10H2,1-3H3,(H,20,21)