[(2S)-1-[(2,6-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-methanoyl-2-methoxy-phenoxy)ethanoate

Systemtic Name: [(2S)-1-[(2,6-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-methanoyl-2-methoxy-phenoxy)ethanoate Openeye Name: [(1S)-2-(2,6-dimethylanilino)-1-methyl-2-oxo-ethyl] 2-(4-formyl-2-methoxy-phenoxy)acetate CAS Name: 2-(4-formyl-2-methoxyphenoxy)acetic acid [(2S)-1-(2,6-dimethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2,6-dimethylanilino)-1-oxopropan-2-yl] 2-(4-formyl-2-methoxyphenoxy)acetate Traditional Name: 2-(4-formyl-2-methoxy-phenoxy)acetic acid [(1S)-2-(2,6-dimethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(C)OC(=O)COC2=C(C=C(C=C2)C=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)[C@H](C)OC(=O)COC2=C(C=C(C=C2)C=O)OC

InChI

InChI=1S/C21H23NO6/c1-13-6-5-7-14(2)20(13)22-21(25)15(3)28-19(24)12-27-17-9-8-16(11-23)10-18(17)26-4/h5-11,15H,12H2,1-4H3,(H,22,25)/t15-/m0/s1