2-azanyl-2-(hydroxymethyl)propane-1,3-diol; (2R)-3-phenyl-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoic acid

Systemtic Name: 2-azanyl-2-(hydroxymethyl)propane-1,3-diol; (2R)-3-phenyl-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoic acid Openeye Name: 2-amino-2-(hydroxymethyl)propane-1,3-diol; (2R)-2-[(4-isopropylcyclohexanecarbonyl)amino]-3-phenyl-propanoic acid CAS Name: 2-amino-2-(hydroxymethyl)propane-1,3-diol; (2R)-2-[[oxo-(4-propan-2-ylcyclohexyl)methyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-amino-2-(hydroxymethyl)propane-1,3-diol; (2R)-3-phenyl-2-[(4-propan-2-ylcyclohexanecarbonyl)amino]propanoic acid Traditional Name: 2-amino-2-methylol-propane-1,3-diol; (2R)-2-[(4-isopropylcyclohexanecarbonyl)amino]-3-phenyl-propionic acid Formula: C23H38N2O6 MolecularWeight: 438.55762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)O.C(C(CO)(CO)N)O

Isomeric SMILES

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

InChI

InChI=1S/C19H27NO3.C4H11NO3/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;5-4(1-6,2-7)3-8/h3-7,13,15-17H,8-12H2,1-2H3,(H,20,21)(H,22,23);6-8H,1-3,5H2/t15?,16?,17-;/m1./s1