1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylpiperidin-1-ium-1-yl)piperidin-1-ium

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylpiperidin-1-ium-1-yl)piperidin-1-ium Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylpiperidin-1-ium-1-yl)piperidin-1-ium CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methyl-1-piperidin-1-iumyl)piperidin-1-ium IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylpiperidin-1-ium-1-yl)piperidin-1-ium Traditional Name: 4-methyl-1-(1-piperonylpiperidin-1-ium-4-yl)piperidin-1-ium Formula: C19H30N2O2+2 MolecularWeight: 318.4537

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1CC[NH+](CC1)C2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H28N2O2/c1-15-4-10-21(11-5-15)17-6-8-20(9-7-17)13-16-2-3-18-19(12-16)23-14-22-18/h2-3,12,15,17H,4-11,13-14H2,1H3/p+2