[(2S)-2-(3,4-dimethoxyphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium Openeye Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]ammonium CAS Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-(4-methyl-1-piperidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium Traditional Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]ammonium Formula: C16H28N2O2+2 MolecularWeight: 280.40572

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(C[NH3+])C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](C[NH3+])C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H26N2O2/c1-12-6-8-18(9-7-12)14(11-17)13-4-5-15(19-2)16(10-13)20-3/h4-5,10,12,14H,6-9,11,17H2,1-3H3/p+2/t14-/m1/s1