[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-methylbutanoate

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-methylbutanoate Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-1-phenyl-ethyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [2-(3,5-dimethylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-2-oxo-1-phenylethyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-(3,5-dimethylanilino)-2-keto-1-phenyl-ethyl] ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC(C1=CC=CC=C1)C(=O)NC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCC(C)C(=O)OC(C1=CC=CC=C1)C(=O)NC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C21H25NO3/c1-5-16(4)21(24)25-19(17-9-7-6-8-10-17)20(23)22-18-12-14(2)11-15(3)13-18/h6-13,16,19H,5H2,1-4H3,(H,22,23)