[1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] (2S)-2-benzamido-3-methyl-butanoate

Systemtic Name: [1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] (2S)-2-benzamido-3-methyl-butanoate Openeye Name: [2-(2-methoxyanilino)-1-methyl-2-oxo-ethyl] (2S)-2-benzamido-3-methyl-butanoate CAS Name: (2S)-2-benzamido-3-methylbutanoic acid [1-(2-methoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-benzamido-3-methylbutanoate Traditional Name: (2S)-2-benzamido-3-methyl-butyric acid [2-keto-1-methyl-2-(o-anisidino)ethyl] ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C(=O)NC1=CC=CC=C1OC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OC(C)C(=O)NC1=CC=CC=C1OC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H26N2O5/c1-14(2)19(24-21(26)16-10-6-5-7-11-16)22(27)29-15(3)20(25)23-17-12-8-9-13-18(17)28-4/h5-15,19H,1-4H3,(H,23,25)(H,24,26)/t15?,19-/m0/s1