2-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)ethanol; 2-phenylethanoic acid

Systemtic Name: 2-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)ethanol; 2-phenylethanoic acid Openeye Name: 2-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)ethanol; 2-phenylacetic acid CAS Name: 2-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)ethanol; 2-phenylacetic acid IUPAC Name: 2-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)ethanol; 2-phenylacetic acid Traditional Name: 2-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)ethanol; 2-phenylacetic acid Formula: C25H34N2O5 MolecularWeight: 442.54786

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1CN(C2)CCO.C1=CC=C(C=C1)CC(=O)O.C1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CN1C2CCC1CN(C2)CCO.C1=CC=C(C=C1)CC(=O)O.C1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C9H18N2O.2C8H8O2/c1-10-8-2-3-9(10)7-11(6-8)4-5-12;2*9-8(10)6-7-4-2-1-3-5-7/h8-9,12H,2-7H2,1H3;2*1-5H,6H2,(H,9,10)