(2S)-2-[[2-[(2S)-2-azanyl-3-oxidanyl-propyl]phenyl]amino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[2-[(2S)-2-azanyl-3-oxidanyl-propyl]phenyl]amino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[2-[(2S)-2-amino-3-hydroxy-propyl]anilino]-3-methyl-butanoic acid CAS Name: (2S)-2-[2-[(2S)-2-amino-3-hydroxypropyl]anilino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[2-[(2S)-2-amino-3-hydroxypropyl]anilino]-3-methylbutanoic acid Traditional Name: (2S)-2-[2-[(2S)-2-amino-3-hydroxy-propyl]anilino]-3-methyl-butyric acid Formula: C14H22N2O3 MolecularWeight: 266.33608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC1=CC=CC=C1CC(CO)N

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC1=CC=CC=C1C[C@@H](CO)N

InChI

InChI=1S/C14H22N2O3/c1-9(2)13(14(18)19)16-12-6-4-3-5-10(12)7-11(15)8-17/h3-6,9,11,13,16-17H,7-8,15H2,1-2H3,(H,18,19)/t11-,13-/m0/s1