(3,4-dimethylphenyl) (2S,3S)-2-benzamido-3-methyl-pentanoate

Systemtic Name: (3,4-dimethylphenyl) (2S,3S)-2-benzamido-3-methyl-pentanoate Openeye Name: (3,4-dimethylphenyl) (2S,3S)-2-benzamido-3-methyl-pentanoate CAS Name: (2S,3S)-2-benzamido-3-methylpentanoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) (2S,3S)-2-benzamido-3-methylpentanoate Traditional Name: (2S,3S)-2-benzamido-3-methyl-valeric acid (3,4-dimethylphenyl) ester Formula: C21H25NO3 MolecularWeight: 339.4281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC1=CC(=C(C=C1)C)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OC1=CC(=C(C=C1)C)C)NC(=O)C2=CC=CC=C2

InChI

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