[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(3-bromanylphenoxy)propanoate

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(3-bromanylphenoxy)propanoate Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-ethyl] 3-(3-bromophenoxy)propanoate CAS Name: 3-(3-bromophenoxy)propanoic acid [2-(3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-2-oxoethyl] 3-(3-bromophenoxy)propanoate Traditional Name: 3-(3-bromophenoxy)propionic acid [2-(3,5-dimethylanilino)-2-keto-ethyl] ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)COC(=O)CCOC2=CC(=CC=C2)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)COC(=O)CCOC2=CC(=CC=C2)Br)C

InChI

InChI=1S/C19H20BrNO4/c1-13-8-14(2)10-16(9-13)21-18(22)12-25-19(23)6-7-24-17-5-3-4-15(20)11-17/h3-5,8-11H,6-7,12H2,1-2H3,(H,21,22)