[1-(1,3-dioxolan-2-ylmethyl)-1-methyl-piperidin-1-ium-4-yl] 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: [1-(1,3-dioxolan-2-ylmethyl)-1-methyl-piperidin-1-ium-4-yl] 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: [1-(1,3-dioxolan-2-ylmethyl)-1-methyl-piperidin-1-ium-4-yl] 2-hydroxy-2,2-diphenyl-acetate CAS Name: 2-hydroxy-2,2-diphenylacetic acid [1-(1,3-dioxolan-2-ylmethyl)-1-methyl-4-piperidin-1-iumyl] ester IUPAC Name: [1-(1,3-dioxolan-2-ylmethyl)-1-methylpiperidin-1-ium-4-yl] 2-hydroxy-2,2-diphenylacetate Traditional Name: 2-hydroxy-2,2-diphenyl-acetic acid [1-(1,3-dioxolan-2-ylmethyl)-1-methyl-piperidin-1-ium-4-yl] ester Formula: C24H30NO5+ MolecularWeight: 412.4987

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)CC4OCCO4

Isomeric SMILES

C[N+]1(CCC(CC1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)CC4OCCO4

InChI

InChI=1S/C24H30NO5/c1-25(18-22-28-16-17-29-22)14-12-21(13-15-25)30-23(26)24(27,19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,21-22,27H,12-18H2,1H3/q+1