2-(1-heptylpiperidin-1-ium-1-yl)ethyl N-(2-pentoxyphenyl)carbamate bromide

Systemtic Name: 2-(1-heptylpiperidin-1-ium-1-yl)ethyl N-(2-pentoxyphenyl)carbamate bromide Openeye Name: 2-(1-heptylpiperidin-1-ium-1-yl)ethyl N-(2-pentoxyphenyl)carbamate bromide CAS Name: N-(2-pentoxyphenyl)carbamic acid 2-(1-heptyl-1-piperidin-1-iumyl)ethyl ester bromide IUPAC Name: 2-(1-heptylpiperidin-1-ium-1-yl)ethyl N-(2-pentoxyphenyl)carbamate bromide Traditional Name: N-(2-amoxyphenyl)carbamic acid 2-(1-heptylpiperidin-1-ium-1-yl)ethyl ester bromide Formula: C26H45BrN2O3 MolecularWeight: 513.5511

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+]1(CCCCC1)CCOC(=O)NC2=CC=CC=C2OCCCCC.[Br-]

Isomeric SMILES

CCCCCCC[N+]1(CCCCC1)CCOC(=O)NC2=CC=CC=C2OCCCCC.[Br-]

InChI

InChI=1S/C26H44N2O3.BrH/c1-3-5-7-8-12-18-28(19-13-9-14-20-28)21-23-31-26(29)27-24-16-10-11-17-25(24)30-22-15-6-4-2;/h10-11,16-17H,3-9,12-15,18-23H2,1-2H3;1H