[6-(6-carboxypyridin-2-yl)pyridin-3-yl]methyl-decyl-azanium chloride

Systemtic Name: [6-(6-carboxypyridin-2-yl)pyridin-3-yl]methyl-decyl-azanium chloride Openeye Name: [6-(6-carboxy-2-pyridyl)-3-pyridyl]methyl-decyl-ammonium chloride CAS Name: [6-(6-carboxy-2-pyridinyl)-3-pyridinyl]methyl-decylammonium chloride IUPAC Name: [6-(6-carboxypyridin-2-yl)pyridin-3-yl]methyl-decylazanium chloride Traditional Name: [6-(6-carboxy-2-pyridyl)-3-pyridyl]methyl-decyl-ammonium chloride Formula: C22H32ClN3O2 MolecularWeight: 405.96138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[NH2+]CC1=CN=C(C=C1)C2=NC(=CC=C2)C(=O)O.[Cl-]

Isomeric SMILES

CCCCCCCCCC[NH2+]CC1=CN=C(C=C1)C2=NC(=CC=C2)C(=O)O.[Cl-]

InChI

InChI=1S/C22H31N3O2.ClH/c1-2-3-4-5-6-7-8-9-15-23-16-18-13-14-19(24-17-18)20-11-10-12-21(25-20)22(26)27;/h10-14,17,23H,2-9,15-16H2,1H3,(H,26,27);1H