(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-oxidanyl-2-phenyl-ethanoate; 2-propylpentanoic acid

Systemtic Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-oxidanyl-2-phenyl-ethanoate; 2-propylpentanoic acid Openeye Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenyl-acetate; 2-propylpentanoic acid CAS Name: 2-hydroxy-2-phenylacetic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester; 2-propylpentanoic acid IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate; 2-propylpentanoic acid Traditional Name: 2-hydroxy-2-phenyl-acetic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester; 2-propylvaleric acid Formula: C24H37NO5 MolecularWeight: 419.55428

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)O.CN1C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O

Isomeric SMILES

CCCC(CCC)C(=O)O.CN1C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O

InChI

InChI=1S/C16H21NO3.C8H16O2/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11;1-3-5-7(6-4-2)8(9)10/h2-6,12-15,18H,7-10H2,1H3;7H,3-6H2,1-2H3,(H,9,10)