2-dodecyloxolane; (2-ethyloxolan-2-yl)methyl 2-azanyl-1-methyl-pyridin-1-ium-3-carboxylate; chloride

Systemtic Name: 2-dodecyloxolane; (2-ethyloxolan-2-yl)methyl 2-azanyl-1-methyl-pyridin-1-ium-3-carboxylate; chloride Openeye Name: 2-dodecyltetrahydrofuran; (2-ethyltetrahydrofuran-2-yl)methyl 2-amino-1-methyl-pyridin-1-ium-3-carboxylate; chloride CAS Name: 2-amino-1-methyl-3-pyridin-1-iumcarboxylic acid (2-ethyl-2-oxolanyl)methyl ester; 2-dodecyloxolane; chloride IUPAC Name: 2-dodecyloxolane; (2-ethyloxolan-2-yl)methyl 2-amino-1-methylpyridin-1-ium-3-carboxylate; chloride Traditional Name: 2-amino-1-methyl-pyridin-1-ium-3-carboxylic acid (2-ethyltetrahydrofuran-2-yl)methyl ester; 2-lauryltetrahydrofuran; chloride Formula: C30H53ClN2O4 MolecularWeight: 541.20582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1CCCO1.CCC1(CCCO1)COC(=O)C2=C([N+](=CC=C2)C)N.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC1CCCO1.CCC1(CCCO1)COC(=O)C2=C([N+](=CC=C2)C)N.[Cl-]

InChI

InChI=1S/C16H32O.C14H20N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-13-16-14-12-15-17-16;1-3-14(7-5-9-19-14)10-18-13(17)11-6-4-8-16(2)12(11)15;/h16H,2-15H2,1H3;4,6,8,15H,3,5,7,9-10H2,1-2H3;1H