2-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]ethanoate

Systemtic Name: 2-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]ethanoate Openeye Name: 2-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]acetate CAS Name: 2-[[(2S,3S)-3-methyl-1-oxo-2-phenylpentyl]amino]acetate IUPAC Name: 2-[[(2S,3S)-3-methyl-2-phenylpentanoyl]amino]acetate Traditional Name: 2-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]acetate Formula: C14H18NO3- MolecularWeight: 248.29762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)NCC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3/c1-3-10(2)13(11-7-5-4-6-8-11)14(18)15-9-12(16)17/h4-8,10,13H,3,9H2,1-2H3,(H,15,18)(H,16,17)/p-1/t10-,13-/m0/s1