[1-[(2,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-[(3R)-3-methylpiperidin-1-yl]methanone

Systemtic Name: [1-[(2,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-[(3R)-3-methylpiperidin-1-yl]methanone Openeye Name: [1-[(2,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-[(3R)-3-methyl-1-piperidyl]methanone CAS Name: [1-[(2,4-dimethoxyphenyl)methyl]-4-piperidin-1-iumyl]-[(3R)-3-methyl-1-piperidinyl]methanone IUPAC Name: [1-[(2,4-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-[(3R)-3-methylpiperidin-1-yl]methanone Traditional Name: [1-(2,4-dimethoxybenzyl)piperidin-1-ium-4-yl]-[(3R)-3-methylpiperidino]methanone Formula: C21H33N2O3+ MolecularWeight: 361.49832

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2CC[NH+](CC2)CC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

C[C@@H]1CCCN(C1)C(=O)C2CC[NH+](CC2)CC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H32N2O3/c1-16-5-4-10-23(14-16)21(24)17-8-11-22(12-9-17)15-18-6-7-19(25-2)13-20(18)26-3/h6-7,13,16-17H,4-5,8-12,14-15H2,1-3H3/p+1/t16-/m1/s1