N-[(1R,5S)-9-cyclohexyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methoxy-benzamide

Systemtic Name: N-[(1R,5S)-9-cyclohexyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methoxy-benzamide Openeye Name: N-[(1R,5S)-9-cyclohexyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methoxy-benzamide CAS Name: N-[(1R,5S)-9-cyclohexyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methoxybenzamide IUPAC Name: N-[(1R,5S)-9-cyclohexyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methoxybenzamide Traditional Name: N-[(1R,5S)-9-cyclohexyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methoxy-benzamide Formula: C22H33N2O2+ MolecularWeight: 357.50962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2CC3CCCC(C2)[NH+]3C4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2C[C@H]3CCC[C@@H](C2)[NH+]3C4CCCCC4

InChI

InChI=1S/C22H32N2O2/c1-26-21-13-6-5-12-20(21)22(25)23-16-14-18-10-7-11-19(15-16)24(18)17-8-3-2-4-9-17/h5-6,12-13,16-19H,2-4,7-11,14-15H2,1H3,(H,23,25)/p+1/t16?,18-,19+