[1-[(2,4-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-bromanyl-3,4,5-trimethoxy-benzoate

Systemtic Name: [1-[(2,4-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-bromanyl-3,4,5-trimethoxy-benzoate Openeye Name: [2-(2,4-dimethylanilino)-1-methyl-2-oxo-ethyl] 2-bromo-3,4,5-trimethoxy-benzoate CAS Name: 2-bromo-3,4,5-trimethoxybenzoic acid [1-(2,4-dimethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,4-dimethylanilino)-1-oxopropan-2-yl] 2-bromo-3,4,5-trimethoxybenzoate Traditional Name: 2-bromo-3,4,5-trimethoxy-benzoic acid [2-(2,4-dimethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H24BrNO6 MolecularWeight: 466.32236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)OC(=O)C2=CC(=C(C(=C2Br)OC)OC)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)OC(=O)C2=CC(=C(C(=C2Br)OC)OC)OC)C

InChI

InChI=1S/C21H24BrNO6/c1-11-7-8-15(12(2)9-11)23-20(24)13(3)29-21(25)14-10-16(26-4)18(27-5)19(28-6)17(14)22/h7-10,13H,1-6H3,(H,23,24)