(2S,3S)-3-methyl-2-phenylazanyl-pentanoic acid

Systemtic Name: (2S,3S)-3-methyl-2-phenylazanyl-pentanoic acid Openeye Name: (2S,3S)-2-anilino-3-methyl-pentanoic acid CAS Name: (2S,3S)-2-anilino-3-methylpentanoic acid IUPAC Name: (2S,3S)-2-anilino-3-methylpentanoic acid Traditional Name: (2S,3S)-2-anilino-3-methyl-valeric acid Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC1=CC=CC=C1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O)NC1=CC=CC=C1

InChI

InChI=1S/C12H17NO2/c1-3-9(2)11(12(14)15)13-10-7-5-4-6-8-10/h4-9,11,13H,3H2,1-2H3,(H,14,15)/t9-,11-/m0/s1