(2S,3S)-3-methyl-2-[(2-methylphenyl)carbonylamino]pentanoic acid

Systemtic Name: (2S,3S)-3-methyl-2-[(2-methylphenyl)carbonylamino]pentanoic acid Openeye Name: (2S,3S)-3-methyl-2-[(2-methylbenzoyl)amino]pentanoic acid CAS Name: (2S,3S)-3-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]pentanoic acid IUPAC Name: (2S,3S)-3-methyl-2-[(2-methylbenzoyl)amino]pentanoic acid Traditional Name: (2S,3S)-3-methyl-2-(o-toluoylamino)valeric acid Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C1=CC=CC=C1C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O)NC(=O)C1=CC=CC=C1C

InChI

InChI=1S/C14H19NO3/c1-4-9(2)12(14(17)18)15-13(16)11-8-6-5-7-10(11)3/h5-9,12H,4H2,1-3H3,(H,15,16)(H,17,18)/t9-,12-/m0/s1