2-(1-octylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate

Systemtic Name: 2-(1-octylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate Openeye Name: 2-(1-octylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate CAS Name: N-(2-heptoxyphenyl)carbamic acid 2-(1-octyl-1-piperidin-1-iumyl)ethyl ester IUPAC Name: 2-(1-octylpiperidin-1-ium-1-yl)ethyl N-(2-heptoxyphenyl)carbamate Traditional Name: N-(2-heptoxyphenyl)carbamic acid 2-(1-octylpiperidin-1-ium-1-yl)ethyl ester Formula: C29H51N2O3+ MolecularWeight: 475.72684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1(CCCCC1)CCOC(=O)NC2=CC=CC=C2OCCCCCCC

Isomeric SMILES

CCCCCCCC[N+]1(CCCCC1)CCOC(=O)NC2=CC=CC=C2OCCCCCCC

InChI

InChI=1S/C29H50N2O3/c1-3-5-7-9-10-15-21-31(22-16-12-17-23-31)24-26-34-29(32)30-27-19-13-14-20-28(27)33-25-18-11-8-6-4-2/h13-14,19-20H,3-12,15-18,21-26H2,1-2H3/p+1