3-(dimethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-benzamide

Systemtic Name: 3-(dimethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-benzamide Openeye Name: 3-(dimethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-benzamide CAS Name: 3-(dimethylamino)-N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-N-phenethylbenzamide IUPAC Name: 3-(dimethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethylbenzamide Traditional Name: 3-(dimethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-benzamide Formula: C24H34N3O+ MolecularWeight: 380.54626

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)CN(CCC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)N(C)C

Isomeric SMILES

C[NH+]1CCC[C@@H](C1)CN(CCC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)N(C)C

InChI

InChI=1S/C24H33N3O/c1-25(2)23-13-7-12-22(17-23)24(28)27(16-14-20-9-5-4-6-10-20)19-21-11-8-15-26(3)18-21/h4-7,9-10,12-13,17,21H,8,11,14-16,18-19H2,1-3H3/p+1/t21-/m0/s1