[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-phenoxybutanoate

Systemtic Name: [2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-phenoxybutanoate Openeye Name: [2-(2,6-diethylanilino)-2-oxo-ethyl] (2S)-2-phenoxybutanoate CAS Name: (2S)-2-phenoxybutanoic acid [2-(2,6-diethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-diethylanilino)-2-oxoethyl] (2S)-2-phenoxybutanoate Traditional Name: (2S)-2-phenoxybutyric 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)C(CC)OC2=CC=CC=C2

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)[C@H](CC)OC2=CC=CC=C2

InChI

InChI=1S/C22H27NO4/c1-4-16-11-10-12-17(5-2)21(16)23-20(24)15-26-22(25)19(6-3)27-18-13-8-7-9-14-18/h7-14,19H,4-6,15H2,1-3H3,(H,23,24)/t19-/m0/s1