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

Systemtic Name: N-[(1R,5S)-9-cyclopentyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methyl-benzamide Openeye Name: N-[(1R,5S)-9-cyclopentyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methyl-benzamide CAS Name: N-[(1R,5S)-9-cyclopentyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methylbenzamide IUPAC Name: N-[(1R,5S)-9-cyclopentyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methylbenzamide Traditional Name: N-[(1R,5S)-9-cyclopentyl-9-azoniabicyclo[3.3.1]nonan-3-yl]-2-methyl-benzamide Formula: C21H31N2O+ MolecularWeight: 327.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2CC3CCCC(C2)[NH+]3C4CCCC4

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2C[C@H]3CCC[C@@H](C2)[NH+]3C4CCCC4

InChI

InChI=1S/C21H30N2O/c1-15-7-2-5-12-20(15)21(24)22-16-13-18-10-6-11-19(14-16)23(18)17-8-3-4-9-17/h2,5,7,12,16-19H,3-4,6,8-11,13-14H2,1H3,(H,22,24)/p+1/t16?,18-,19+