[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromanylphenoxy)propanoate

Systemtic Name: [2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromanylphenoxy)propanoate Openeye Name: [2-(2,6-diethylanilino)-2-oxo-ethyl] 2-(4-bromophenoxy)propanoate CAS Name: 2-(4-bromophenoxy)propanoic acid [2-(2,6-diethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-diethylanilino)-2-oxoethyl] 2-(4-bromophenoxy)propanoate Traditional Name: 2-(4-bromophenoxy)propionic acid [2-(2,6-diethylanilino)-2-keto-ethyl] ester Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)C(C)OC2=CC=C(C=C2)Br

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)C(C)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C21H24BrNO4/c1-4-15-7-6-8-16(5-2)20(15)23-19(24)13-26-21(25)14(3)27-18-11-9-17(22)10-12-18/h6-12,14H,4-5,13H2,1-3H3,(H,23,24)