2-Chloro-6-methylcarbanilic acid 3-quinuclidinyl ester hydrochloride

1-azoniabicyclo[2.2.2]octan-3-yl N-(2-chloro-6-methylphenyl)carbamate chloride

CAS: 29440-70-8

Molecular Formula	`C15H20Cl2N2O2`
Molecular Weight	331.2 g/mol
Topological Polar Surface Area	42.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	330.09018
Heavy Atoms	21
Complexity	358.0

Chemical Identifiers

CAS Number	29440-70-8
SMILES	`CC1=C(C(=CC=C1)Cl)NC(=O)OC2C[NH+]3CCC2CC3.[Cl-]`
InChIKey	`WTTDFDIVNVDRHP-UHFFFAOYSA-N`

📖 Product Overview

2-Chloro-6-methylcarbanilic acid 3-quinuclidinyl ester hydrochloride (CAS: 29440-70-8) is a chemical compound with molecular formula C15H20Cl2N2O2 and molecular weight 331.2 g/mol. Its IUPAC systematic name is 1-azoniabicyclo[2.2.2]octan-3-yl N-(2-chloro-6-methylphenyl)carbamate chloride. Topological Polar Surface Area 42.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 330.09018 Heavy Atoms 21 Complexity 358.0 InChI Key: WTTDFDIVNVDRHP-UHFFFAOYSA-N. SMILES: CC1=C(C(=CC=C1)Cl)NC(=O)OC2C[NH+]3CCC2CC3.[Cl-].

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