[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(3-methylphenoxy)propanoate

Systemtic Name: [2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(3-methylphenoxy)propanoate Openeye Name: [2-(3,4-diethoxyanilino)-2-oxo-ethyl] (2S)-2-(3-methylphenoxy)propanoate CAS Name: (2S)-2-(3-methylphenoxy)propanoic acid [2-(3,4-diethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-diethoxyanilino)-2-oxoethyl] (2S)-2-(3-methylphenoxy)propanoate Traditional Name: (2S)-2-(3-methylphenoxy)propionic acid [2-(3,4-diethoxyanilino)-2-keto-ethyl] ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)COC(=O)C(C)OC2=CC=CC(=C2)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)COC(=O)[C@H](C)OC2=CC=CC(=C2)C)OCC

InChI

InChI=1S/C22H27NO6/c1-5-26-19-11-10-17(13-20(19)27-6-2)23-21(24)14-28-22(25)16(4)29-18-9-7-8-15(3)12-18/h7-13,16H,5-6,14H2,1-4H3,(H,23,24)/t16-/m0/s1