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

Systemtic Name: 3-[(1R,5S)-2-[2-(3-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol Openeye Name: 3-[(1R,5S)-2-[2-(3-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol CAS Name: 3-[(1R,5S)-2-[2-(3-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol IUPAC Name: 3-[(1R,5S)-2-[2-(3-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol Traditional Name: 3-[(1R,5S)-2-[2-(3-nitrophenyl)ethyl]-2-azabicyclo[3.3.1]nonan-5-yl]phenol Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O3/c25-21-8-2-5-18(15-21)22-10-3-7-20(16-22)23(13-11-22)12-9-17-4-1-6-19(14-17)24(26)27/h1-2,4-6,8,14-15,20,25H,3,7,9-13,16H2/t20-,22+/m1/s1