(2S)-2-[[2-(hydroxymethyl)phenyl]amino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[2-(hydroxymethyl)phenyl]amino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[2-(hydroxymethyl)anilino]-3-methyl-butanoic acid CAS Name: (2S)-2-[2-(hydroxymethyl)anilino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[2-(hydroxymethyl)anilino]-3-methylbutanoic acid Traditional Name: (2S)-3-methyl-2-(2-methylolanilino)butyric acid Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC1=CC=CC=C1CO

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC1=CC=CC=C1CO

InChI

InChI=1S/C12H17NO3/c1-8(2)11(12(15)16)13-10-6-4-3-5-9(10)7-14/h3-6,8,11,13-14H,7H2,1-2H3,(H,15,16)/t11-/m0/s1