N-(2-pentoxyphenyl)carbamate; 2-(1-pentylpiperidin-1-ium-1-yl)ethanol; bromide

Systemtic Name: N-(2-pentoxyphenyl)carbamate; 2-(1-pentylpiperidin-1-ium-1-yl)ethanol; bromide Openeye Name: N-(2-pentoxyphenyl)carbamate; 2-(1-pentylpiperidin-1-ium-1-yl)ethanol; bromide CAS Name: N-(2-pentoxyphenyl)carbamate; 2-(1-pentyl-1-piperidin-1-iumyl)ethanol; bromide IUPAC Name: N-(2-pentoxyphenyl)carbamate; 2-(1-pentylpiperidin-1-ium-1-yl)ethanol; bromide Traditional Name: N-(2-amoxyphenyl)carbamate; 2-(1-amylpiperidin-1-ium-1-yl)ethanol; bromide Formula: C24H42BrN2O4- MolecularWeight: 502.50528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1(CCCCC1)CCO.CCCCCOC1=CC=CC=C1NC(=O)[O-].[Br-]

Isomeric SMILES

CCCCC[N+]1(CCCCC1)CCO.CCCCCOC1=CC=CC=C1NC(=O)[O-].[Br-]

InChI

InChI=1S/C12H17NO3.C12H26NO.BrH/c1-2-3-6-9-16-11-8-5-4-7-10(11)13-12(14)15;1-2-3-5-8-13(11-12-14)9-6-4-7-10-13;/h4-5,7-8,13H,2-3,6,9H2,1H3,(H,14,15);14H,2-12H2,1H3;1H/q;+1;/p-2