(2,6-dimethylphenyl) (2S,3S)-2-benzamido-3-methyl-pentanoate

Systemtic Name: (2,6-dimethylphenyl) (2S,3S)-2-benzamido-3-methyl-pentanoate Openeye Name: (2,6-dimethylphenyl) (2S,3S)-2-benzamido-3-methyl-pentanoate CAS Name: (2S,3S)-2-benzamido-3-methylpentanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) (2S,3S)-2-benzamido-3-methylpentanoate Traditional Name: (2S,3S)-2-benzamido-3-methyl-valeric acid (2,6-dimethylphenyl) ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC1=C(C=CC=C1C)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OC1=C(C=CC=C1C)C)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H25NO3/c1-5-14(2)18(22-20(23)17-12-7-6-8-13-17)21(24)25-19-15(3)10-9-11-16(19)4/h6-14,18H,5H2,1-4H3,(H,22,23)/t14-,18-/m0/s1