[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(3,4-dimethylphenoxy)ethanoate

Systemtic Name: [2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(3,4-dimethylphenoxy)ethanoate Openeye Name: [2-(2,6-diethylanilino)-2-oxo-ethyl] 2-(3,4-dimethylphenoxy)acetate CAS Name: 2-(3,4-dimethylphenoxy)acetic acid [2-(2,6-diethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-diethylanilino)-2-oxoethyl] 2-(3,4-dimethylphenoxy)acetate Traditional Name: 2-(3,4-dimethylphenoxy)acetic acid [2-(2,6-diethylanilino)-2-keto-ethyl] ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)COC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)COC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C22H27NO4/c1-5-17-8-7-9-18(6-2)22(17)23-20(24)13-27-21(25)14-26-19-11-10-15(3)16(4)12-19/h7-12H,5-6,13-14H2,1-4H3,(H,23,24)