(1R)-1-(3,4-dimethylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethanamine

Systemtic Name: (1R)-1-(3,4-dimethylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethanamine Openeye Name: (1R)-1-(3,4-dimethylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethanamine CAS Name: (1R)-1-(3,4-dimethylphenyl)-2-(4-methyl-1-piperidin-1-iumyl)ethanamine IUPAC Name: (1R)-1-(3,4-dimethylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethanamine Traditional Name: [(1R)-1-(3,4-dimethylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]amine Formula: C16H27N2+ MolecularWeight: 247.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(C2=CC(=C(C=C2)C)C)N

Isomeric SMILES

CC1CC[NH+](CC1)C[C@@H](C2=CC(=C(C=C2)C)C)N

InChI

InChI=1S/C16H26N2/c1-12-6-8-18(9-7-12)11-16(17)15-5-4-13(2)14(3)10-15/h4-5,10,12,16H,6-9,11,17H2,1-3H3/p+1/t16-/m0/s1