[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate

Systemtic Name: [2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate Openeye Name: [2-(4-bromoanilino)-2-oxo-ethyl] 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-4,5-dimethoxybenzoic acid [2-(4-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromoanilino)-2-oxoethyl] 2-(2,2-dimethylpropanoylamino)-4,5-dimethoxybenzoate Traditional Name: 4,5-dimethoxy-2-(pivaloylamino)benzoic acid [2-(4-bromoanilino)-2-keto-ethyl] ester Formula: C22H25BrN2O6 MolecularWeight: 493.3477

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC(=O)NC2=CC=C(C=C2)Br)OC)OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC(=O)NC2=CC=C(C=C2)Br)OC)OC

InChI

InChI=1S/C22H25BrN2O6/c1-22(2,3)21(28)25-16-11-18(30-5)17(29-4)10-15(16)20(27)31-12-19(26)24-14-8-6-13(23)7-9-14/h6-11H,12H2,1-5H3,(H,24,26)(H,25,28)