3-[[[8-(phenylcarbonyl)-8-azabicyclo[3.2.1]octan-3-yl]methylamino]methyl]-2,3-dihydrochromen-4-one hydrochloride

Systemtic Name: 3-[[[8-(phenylcarbonyl)-8-azabicyclo[3.2.1]octan-3-yl]methylamino]methyl]-2,3-dihydrochromen-4-one hydrochloride Openeye Name: 3-[[(8-benzoyl-8-azabicyclo[3.2.1]octan-3-yl)methylamino]methyl]chroman-4-one hydrochloride CAS Name: 3-[[(8-benzoyl-8-azabicyclo[3.2.1]octan-3-yl)methylamino]methyl]-3,4-dihydro-2H-1-benzopyran-4-one hydrochloride IUPAC Name: 3-[[(8-benzoyl-8-azabicyclo[3.2.1]octan-3-yl)methylamino]methyl]-2,3-dihydrochromen-4-one hydrochloride Traditional Name: 3-[[(8-benzoyl-8-azabicyclo[3.2.1]octan-3-yl)methylamino]methyl]chroman-4-one hydrochloride Formula: C25H29ClN2O3 MolecularWeight: 440.96236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1N2C(=O)C3=CC=CC=C3)CNCC4COC5=CC=CC=C5C4=O.Cl

Isomeric SMILES

C1CC2CC(CC1N2C(=O)C3=CC=CC=C3)CNCC4COC5=CC=CC=C5C4=O.Cl

InChI

InChI=1S/C25H28N2O3.ClH/c28-24-19(16-30-23-9-5-4-8-22(23)24)15-26-14-17-12-20-10-11-21(13-17)27(20)25(29)18-6-2-1-3-7-18;/h1-9,17,19-21,26H,10-16H2;1H