(2S,3S)-4-methyl-3-oxidanyl-2-[(phenylmethyl)amino]pentanoic acid

Systemtic Name: (2S,3S)-4-methyl-3-oxidanyl-2-[(phenylmethyl)amino]pentanoic acid Openeye Name: (2S,3S)-2-(benzylamino)-3-hydroxy-4-methyl-pentanoic acid CAS Name: (2S,3S)-3-hydroxy-4-methyl-2-[(phenylmethyl)amino]pentanoic acid IUPAC Name: (2S,3S)-2-(benzylamino)-3-hydroxy-4-methylpentanoic acid Traditional Name: (2S,3S)-2-(benzylamino)-3-hydroxy-4-methyl-valeric acid Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C(=O)O)NCC1=CC=CC=C1)O

Isomeric SMILES

CC(C)[C@@H]([C@@H](C(=O)O)NCC1=CC=CC=C1)O

InChI

InChI=1S/C13H19NO3/c1-9(2)12(15)11(13(16)17)14-8-10-6-4-3-5-7-10/h3-7,9,11-12,14-15H,8H2,1-2H3,(H,16,17)/t11-,12-/m0/s1