1-azabicyclo[3.2.1]octan-6-ol; 2-phenylethanoic acid; hydrochloride

Systemtic Name: 1-azabicyclo[3.2.1]octan-6-ol; 2-phenylethanoic acid; hydrochloride Openeye Name: 1-azabicyclo[3.2.1]octan-6-ol; 2-phenylacetic acid; hydrochloride CAS Name: 1-azabicyclo[3.2.1]octan-6-ol; 2-phenylacetic acid; hydrochloride IUPAC Name: 1-azabicyclo[3.2.1]octan-6-ol; 2-phenylacetic acid; hydrochloride Traditional Name: 1-azabicyclo[3.2.1]octan-6-ol; 2-phenylacetic acid; hydrochloride Formula: C23H30ClNO5 MolecularWeight: 435.941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2CN(C1)CC2O.C1=CC=C(C=C1)CC(=O)O.C1=CC=C(C=C1)CC(=O)O.Cl

Isomeric SMILES

C1CC2CN(C1)CC2O.C1=CC=C(C=C1)CC(=O)O.C1=CC=C(C=C1)CC(=O)O.Cl

InChI

InChI=1S/2C8H8O2.C7H13NO.ClH/c2*9-8(10)6-7-4-2-1-3-5-7;9-7-5-8-3-1-2-6(7)4-8;/h2*1-5H,6H2,(H,9,10);6-7,9H,1-5H2;1H