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

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-[(2-methoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl] (2S)-2-[(2-methoxybenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2-methoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-(2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylanilino)-2-oxoethyl] (2S)-2-[(2-methoxybenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-3-methyl-2-(o-anisoylamino)butyric acid [2-keto-2-(o-toluidino)ethyl] ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)COC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)COC(=O)[C@H](C(C)C)NC(=O)C2=CC=CC=C2OC

InChI

InChI=1S/C22H26N2O5/c1-14(2)20(24-21(26)16-10-6-8-12-18(16)28-4)22(27)29-13-19(25)23-17-11-7-5-9-15(17)3/h5-12,14,20H,13H2,1-4H3,(H,23,25)(H,24,26)/t20-/m0/s1