(2R)-3-phenyl-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoic acid; sodium

Systemtic Name: (2R)-3-phenyl-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoic acid; sodium Openeye Name: (2R)-2-[(4-isopropylcyclohexanecarbonyl)amino]-3-phenyl-propanoic acid; sodium CAS Name: (2R)-2-[[oxo-(4-propan-2-ylcyclohexyl)methyl]amino]-3-phenylpropanoic acid; sodium IUPAC Name: (2R)-3-phenyl-2-[(4-propan-2-ylcyclohexanecarbonyl)amino]propanoic acid; sodium Traditional Name: (2R)-2-[(4-isopropylcyclohexanecarbonyl)amino]-3-phenyl-propionic acid; sodium Formula: C19H27NNaO3 MolecularWeight: 340.41235

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)O.[Na]

Isomeric SMILES

CC(C)C1CCC(CC1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)O.[Na]

InChI

InChI=1S/C19H27NO3.Na/c1-13(2)15-8-10-16(11-9-15)18(21)20-17(19(22)23)12-14-6-4-3-5-7-14;/h3-7,13,15-17H,8-12H2,1-2H3,(H,20,21)(H,22,23);/t15?,16?,17-;/m1./s1