(2R)-2-[[(2S)-2-methyl-2-oxidanyl-4-phenyl-but-3-ynyl]amino]hexanoic acid

Systemtic Name: (2R)-2-[[(2S)-2-methyl-2-oxidanyl-4-phenyl-but-3-ynyl]amino]hexanoic acid Openeye Name: (2R)-2-[[(2S)-2-hydroxy-2-methyl-4-phenyl-but-3-ynyl]amino]hexanoic acid CAS Name: (2R)-2-[[(2S)-2-hydroxy-2-methyl-4-phenylbut-3-ynyl]amino]hexanoic acid IUPAC Name: (2R)-2-[[(2S)-2-hydroxy-2-methyl-4-phenylbut-3-ynyl]amino]hexanoic acid Traditional Name: (2R)-2-[[(2S)-2-hydroxy-2-methyl-4-phenyl-but-3-ynyl]amino]hexanoic acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NCC(C)(C#CC1=CC=CC=C1)O

Isomeric SMILES

CCCC[C@H](C(=O)O)NC[C@](C)(C#CC1=CC=CC=C1)O

InChI

InChI=1S/C17H23NO3/c1-3-4-10-15(16(19)20)18-13-17(2,21)12-11-14-8-6-5-7-9-14/h5-9,15,18,21H,3-4,10,13H2,1-2H3,(H,19,20)/t15-,17+/m1/s1