[3-(2-phenethyl-2-azabicyclo[3.2.1]octan-5-yl)phenyl] propanoate hydrobromide

Systemtic Name: [3-(2-phenethyl-2-azabicyclo[3.2.1]octan-5-yl)phenyl] propanoate hydrobromide Openeye Name: [3-(2-phenethyl-2-azabicyclo[3.2.1]octan-5-yl)phenyl] propanoate hydrobromide CAS Name: propanoic acid [3-(2-phenethyl-2-azabicyclo[3.2.1]octan-5-yl)phenyl] ester hydrobromide IUPAC Name: [3-(2-phenethyl-2-azabicyclo[3.2.1]octan-5-yl)phenyl] propanoate hydrobromide Traditional Name: propionic acid [3-(2-phenethyl-2-azabicyclo[3.2.1]octan-5-yl)phenyl] ester hydrobromide Formula: C24H30BrNO2 MolecularWeight: 444.4045

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=CC(=C1)C23CCC(C2)N(CC3)CCC4=CC=CC=C4.Br

Isomeric SMILES

CCC(=O)OC1=CC=CC(=C1)C23CCC(C2)N(CC3)CCC4=CC=CC=C4.Br

InChI

InChI=1S/C24H29NO2.BrH/c1-2-23(26)27-22-10-6-9-20(17-22)24-13-11-21(18-24)25(16-14-24)15-12-19-7-4-3-5-8-19;/h3-10,17,21H,2,11-16,18H2,1H3;1H