(3S)-1-cyclobutyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-cyclobutyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-piperidin-1-ium-3-amine Openeye Name: (3S)-1-cyclobutyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-piperidin-1-ium-3-amine CAS Name: (3S)-1-cyclobutyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-piperidin-1-iumamine IUPAC Name: (3S)-1-cyclobutyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpiperidin-1-ium-3-amine Traditional Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-homoveratryl-methyl-amine Formula: C20H33N2O2+ MolecularWeight: 333.48822

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCC[NH+](C2)C3CCC3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)[C@H]2CCC[NH+](C2)C3CCC3

InChI

InChI=1S/C20H32N2O2/c1-21(18-8-5-12-22(15-18)17-6-4-7-17)13-11-16-9-10-19(23-2)20(14-16)24-3/h9-10,14,17-18H,4-8,11-13,15H2,1-3H3/p+1/t18-/m0/s1