2-(1-methylpiperidin-1-ium-1-yl)ethyl 2,2-bis(4-methoxyphenyl)-2-oxidanyl-ethanoate bromide

Systemtic Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl 2,2-bis(4-methoxyphenyl)-2-oxidanyl-ethanoate bromide Openeye Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl 2-hydroxy-2,2-bis(4-methoxyphenyl)acetate bromide CAS Name: 2-hydroxy-2,2-bis(4-methoxyphenyl)acetic acid 2-(1-methyl-1-piperidin-1-iumyl)ethyl ester bromide IUPAC Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl 2-hydroxy-2,2-bis(4-methoxyphenyl)acetate bromide Traditional Name: 2-hydroxy-2,2-bis(4-methoxyphenyl)acetic acid 2-(1-methylpiperidin-1-ium-1-yl)ethyl ester bromide Formula: C24H32BrNO5 MolecularWeight: 494.41858

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCOC(=O)C(C2=CC=C(C=C2)OC)(C3=CC=C(C=C3)OC)O.[Br-]

Isomeric SMILES

C[N+]1(CCCCC1)CCOC(=O)C(C2=CC=C(C=C2)OC)(C3=CC=C(C=C3)OC)O.[Br-]

InChI

InChI=1S/C24H32NO5.BrH/c1-25(15-5-4-6-16-25)17-18-30-23(26)24(27,19-7-11-21(28-2)12-8-19)20-9-13-22(29-3)14-10-20;/h7-14,27H,4-6,15-18H2,1-3H3;1H/q+1;/p-1