[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(4-tert-butylphenoxy)propanoate

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(4-tert-butylphenoxy)propanoate Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl] (2S)-2-(4-tert-butylphenoxy)propanoate CAS Name: (2S)-2-(4-tert-butylphenoxy)propanoic acid [2-(2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylanilino)-2-oxoethyl] (2S)-2-(4-tert-butylphenoxy)propanoate Traditional Name: (2S)-2-(4-tert-butylphenoxy)propionic acid [2-keto-2-(o-toluidino)ethyl] ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)COC(=O)C(C)OC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)COC(=O)[C@H](C)OC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H27NO4/c1-15-8-6-7-9-19(15)23-20(24)14-26-21(25)16(2)27-18-12-10-17(11-13-18)22(3,4)5/h6-13,16H,14H2,1-5H3,(H,23,24)/t16-/m0/s1