[(2R)-1-[(2,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] (2S,3S)-2-benzamido-3-methyl-pentanoate

Systemtic Name: [(2R)-1-[(2,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] (2S,3S)-2-benzamido-3-methyl-pentanoate Openeye Name: [(1R)-2-(2,5-dimethylanilino)-1-methyl-2-oxo-ethyl] (2S,3S)-2-benzamido-3-methyl-pentanoate CAS Name: (2S,3S)-2-benzamido-3-methylpentanoic acid [(2R)-1-(2,5-dimethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2,5-dimethylanilino)-1-oxopropan-2-yl] (2S,3S)-2-benzamido-3-methylpentanoate Traditional Name: (2S,3S)-2-benzamido-3-methyl-valeric acid [(1R)-2-(2,5-dimethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C24H30N2O4 MolecularWeight: 410.506

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC(C)C(=O)NC1=C(C=CC(=C1)C)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O[C@H](C)C(=O)NC1=C(C=CC(=C1)C)C)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C24H30N2O4/c1-6-16(3)21(26-23(28)19-10-8-7-9-11-19)24(29)30-18(5)22(27)25-20-14-15(2)12-13-17(20)4/h7-14,16,18,21H,6H2,1-5H3,(H,25,27)(H,26,28)/t16-,18+,21-/m0/s1