(2R)-2-[[(2R)-2-methyl-2-oxidanyl-hept-3-ynyl]amino]-3-phenyl-propanoic acid

Systemtic Name: (2R)-2-[[(2R)-2-methyl-2-oxidanyl-hept-3-ynyl]amino]-3-phenyl-propanoic acid Openeye Name: (2R)-2-[[(2R)-2-hydroxy-2-methyl-hept-3-ynyl]amino]-3-phenyl-propanoic acid CAS Name: (2R)-2-[[(2R)-2-hydroxy-2-methylhept-3-ynyl]amino]-3-phenylpropanoic acid IUPAC Name: (2R)-2-[[(2R)-2-hydroxy-2-methylhept-3-ynyl]amino]-3-phenylpropanoic acid Traditional Name: (2R)-2-[[(2R)-2-hydroxy-2-methyl-hept-3-ynyl]amino]-3-phenyl-propionic acid Formula: C17H23NO3 MolecularWeight: 289.36942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC(C)(CNC(CC1=CC=CC=C1)C(=O)O)O

Isomeric SMILES

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

InChI

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