(2S)-3-methyl-2-[methyl-[(2R)-2-oxidanyl-3-phenyl-propanoyl]amino]butanoate

Systemtic Name: (2S)-3-methyl-2-[methyl-[(2R)-2-oxidanyl-3-phenyl-propanoyl]amino]butanoate Openeye Name: (2S)-2-[[(2R)-2-hydroxy-3-phenyl-propanoyl]-methyl-amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2R)-2-hydroxy-1-oxo-3-phenylpropyl]-methylamino]-3-methylbutanoate IUPAC Name: (2S)-2-[[(2R)-2-hydroxy-3-phenylpropanoyl]-methylamino]-3-methylbutanoate Traditional Name: (2S)-2-[[(2R)-2-hydroxy-3-phenyl-propanoyl]-methyl-amino]-3-methyl-butyrate Formula: C15H20NO4- MolecularWeight: 278.3236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])N(C)C(=O)C(CC1=CC=CC=C1)O

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])N(C)C(=O)[C@@H](CC1=CC=CC=C1)O

InChI

InChI=1S/C15H21NO4/c1-10(2)13(15(19)20)16(3)14(18)12(17)9-11-7-5-4-6-8-11/h4-8,10,12-13,17H,9H2,1-3H3,(H,19,20)/p-1/t12-,13+/m1/s1