[2-[(4-hydroxyphenyl)amino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate

Systemtic Name: [2-[(4-hydroxyphenyl)amino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate Openeye Name: [2-(4-hydroxyanilino)-2-oxo-ethyl] (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]butanoic acid [2-(4-hydroxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-hydroxyanilino)-2-oxoethyl] (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(m-toluoylamino)butyric acid [2-(4-hydroxyanilino)-2-keto-ethyl] ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCC(=O)NC2=CC=C(C=C2)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)OCC(=O)NC2=CC=C(C=C2)O

InChI

InChI=1S/C21H24N2O5/c1-13(2)19(23-20(26)15-6-4-5-14(3)11-15)21(27)28-12-18(25)22-16-7-9-17(24)10-8-16/h4-11,13,19,24H,12H2,1-3H3,(H,22,25)(H,23,26)/t19-/m0/s1