1-azoniabicyclo[2.2.2]octan-3-yl N-(3-pentoxyphenyl)carbamate chloride

Systemtic Name: 1-azoniabicyclo[2.2.2]octan-3-yl N-(3-pentoxyphenyl)carbamate chloride Openeye Name: quinuclidin-1-ium-3-yl N-(3-pentoxyphenyl)carbamate chloride CAS Name: N-(3-pentoxyphenyl)carbamic acid 1-azoniabicyclo[2.2.2]octan-3-yl ester chloride IUPAC Name: 1-azoniabicyclo[2.2.2]octan-3-yl N-(3-pentoxyphenyl)carbamate chloride Traditional Name: N-(3-amoxyphenyl)carbamic acid quinuclidin-1-ium-3-yl ester chloride Formula: C19H29ClN2O3 MolecularWeight: 368.89816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)NC(=O)OC2C[NH+]3CCC2CC3.[Cl-]

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)NC(=O)OC2C[NH+]3CCC2CC3.[Cl-]

InChI

InChI=1S/C19H28N2O3.ClH/c1-2-3-4-12-23-17-7-5-6-16(13-17)20-19(22)24-18-14-21-10-8-15(18)9-11-21;/h5-7,13,15,18H,2-4,8-12,14H2,1H3,(H,20,22);1H