(2S,3S)-3-methyl-2-[2-(2-methylphenyl)ethanoylamino]pentanoate

Systemtic Name: (2S,3S)-3-methyl-2-[2-(2-methylphenyl)ethanoylamino]pentanoate Openeye Name: (2S,3S)-3-methyl-2-[[2-(o-tolyl)acetyl]amino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[[2-(2-methylphenyl)-1-oxoethyl]amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-[[2-(2-methylphenyl)acetyl]amino]pentanoate Traditional Name: (2S,3S)-3-methyl-2-[[2-(o-tolyl)acetyl]amino]valerate Formula: C15H20NO3- MolecularWeight: 262.3242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)CC1=CC=CC=C1C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)CC1=CC=CC=C1C

InChI

InChI=1S/C15H21NO3/c1-4-10(2)14(15(18)19)16-13(17)9-12-8-6-5-7-11(12)3/h5-8,10,14H,4,9H2,1-3H3,(H,16,17)(H,18,19)/p-1/t10-,14-/m0/s1