(2S,3S)-3-methyl-2-[[(2S)-2-phenyl-2-pyrrolidin-1-yl-ethanoyl]amino]pentanoic acid

Systemtic Name: (2S,3S)-3-methyl-2-[[(2S)-2-phenyl-2-pyrrolidin-1-yl-ethanoyl]amino]pentanoic acid Openeye Name: (2S,3S)-3-methyl-2-[[(2S)-2-phenyl-2-pyrrolidin-1-yl-acetyl]amino]pentanoic acid CAS Name: (2S,3S)-3-methyl-2-[[(2S)-1-oxo-2-phenyl-2-(1-pyrrolidinyl)ethyl]amino]pentanoic acid IUPAC Name: (2S,3S)-3-methyl-2-[[(2S)-2-phenyl-2-pyrrolidin-1-ylacetyl]amino]pentanoic acid Traditional Name: (2S,3S)-3-methyl-2-[[(2S)-2-phenyl-2-pyrrolidino-acetyl]amino]valeric acid Formula: C18H26N2O3 MolecularWeight: 318.41064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C(C1=CC=CC=C1)N2CCCC2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O)NC(=O)[C@H](C1=CC=CC=C1)N2CCCC2

InChI

InChI=1S/C18H26N2O3/c1-3-13(2)15(18(22)23)19-17(21)16(20-11-7-8-12-20)14-9-5-4-6-10-14/h4-6,9-10,13,15-16H,3,7-8,11-12H2,1-2H3,(H,19,21)(H,22,23)/t13-,15-,16-/m0/s1