3-[(1R,5S)-2-[2-(2-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol hydrochloride

Systemtic Name: 3-[(1R,5S)-2-[2-(2-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol hydrochloride Openeye Name: 3-[(1R,5S)-2-[2-(2-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol hydrochloride CAS Name: 3-[(1R,5S)-2-[2-(2-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol hydrochloride IUPAC Name: 3-[(1R,5S)-2-[2-(2-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol hydrochloride Traditional Name: 3-[(1R,5S)-2-[2-(2-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol hydrochloride Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(C1)(CCN2CCC3=CC=CC=C3[N+](=O)[O-])C4=CC(=CC=C4)O.Cl

Isomeric SMILES

C1C[C@@H]2C[C@](C1)(CCN2CCC3=CC=CC=C3[N+](=O)[O-])C4=CC(=CC=C4)O.Cl

InChI

InChI=1S/C22H26N2O3.ClH/c25-20-8-3-6-18(15-20)22-11-4-7-19(16-22)23(14-12-22)13-10-17-5-1-2-9-21(17)24(26)27;/h1-3,5-6,8-9,15,19,25H,4,7,10-14,16H2;1H/t19-,22+;/m1./s1