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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2CC3CCCC(C2)[NH+]3C4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2C[C@H]3CCC[C@@H](C2)[NH+]3C4CCCCC4

InChI

InChI=1S/C22H32N2O2/c1-26-21-12-5-7-16(13-21)22(25)23-17-14-19-10-6-11-20(15-17)24(19)18-8-3-2-4-9-18/h5,7,12-13,17-20H,2-4,6,8-11,14-15H2,1H3,(H,23,25)/p+1/t17?,19-,20+