(2S)-4-methyl-2-(phenoxycarbonylamino)pentanoic acid

Systemtic Name: (2S)-4-methyl-2-(phenoxycarbonylamino)pentanoic acid Openeye Name: (2S)-4-methyl-2-(phenoxycarbonylamino)pentanoic acid CAS Name: (2S)-4-methyl-2-[[oxo(phenoxy)methyl]amino]pentanoic acid IUPAC Name: (2S)-4-methyl-2-(phenoxycarbonylamino)pentanoic acid Traditional Name: (2S)-2-(carbophenoxyamino)-4-methyl-valeric acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4/c1-9(2)8-11(12(15)16)14-13(17)18-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,17)(H,15,16)/t11-/m0/s1