1,3-bis(1-methylpiperidin-1-ium-1-yl)propan-2-yl propanoate

Systemtic Name: 1,3-bis(1-methylpiperidin-1-ium-1-yl)propan-2-yl propanoate Openeye Name: [2-(1-methylpiperidin-1-ium-1-yl)-1-[(1-methylpiperidin-1-ium-1-yl)methyl]ethyl] propanoate CAS Name: propanoic acid 1,3-bis(1-methyl-1-piperidin-1-iumyl)propan-2-yl ester IUPAC Name: 1,3-bis(1-methylpiperidin-1-ium-1-yl)propan-2-yl propanoate Traditional Name: propionic acid [2-(1-methylpiperidin-1-ium-1-yl)-1-[(1-methylpiperidin-1-ium-1-yl)methyl]ethyl] ester Formula: C18H36N2O2+2 MolecularWeight: 312.49064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C[N+]1(CCCCC1)C)C[N+]2(CCCCC2)C

Isomeric SMILES

CCC(=O)OC(C[N+]1(CCCCC1)C)C[N+]2(CCCCC2)C

InChI

InChI=1S/C18H36N2O2/c1-4-18(21)22-17(15-19(2)11-7-5-8-12-19)16-20(3)13-9-6-10-14-20/h17H,4-16H2,1-3H3/q+2