4-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-N-phenyl-benzamide

Systemtic Name: 4-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-N-phenyl-benzamide Openeye Name: 4-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-N-phenyl-benzamide CAS Name: 4-[[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]methyl]-N-phenylbenzamide IUPAC Name: 4-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-N-phenylbenzamide Traditional Name: 4-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-N-phenyl-benzamide Formula: C21H27N2O+ MolecularWeight: 323.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C21H26N2O/c1-16-12-17(2)14-23(13-16)15-18-8-10-19(11-9-18)21(24)22-20-6-4-3-5-7-20/h3-11,16-17H,12-15H2,1-2H3,(H,22,24)/p+1/t16-,17-/m1/s1