[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl] 2-bromanyl-3,4,5-trimethoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl] 2-bromanyl-3,4,5-trimethoxy-benzoate Openeye Name: [2-oxo-2-(4-phenoxyanilino)ethyl] 2-bromo-3,4,5-trimethoxy-benzoate CAS Name: 2-bromo-3,4,5-trimethoxybenzoic acid [2-oxo-2-(4-phenoxyanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenoxyanilino)ethyl] 2-bromo-3,4,5-trimethoxybenzoate Traditional Name: 2-bromo-3,4,5-trimethoxy-benzoic acid [2-keto-2-(4-phenoxyanilino)ethyl] ester Formula: C24H22BrNO7 MolecularWeight: 516.33798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)Br)OC)OC

InChI

InChI=1S/C24H22BrNO7/c1-29-19-13-18(21(25)23(31-3)22(19)30-2)24(28)32-14-20(27)26-15-9-11-17(12-10-15)33-16-7-5-4-6-8-16/h4-13H,14H2,1-3H3,(H,26,27)