pyridin-3-yl 4,5-bis(acetyloxymethyl)-2-methyl-dodecanoate hydrochloride

Systemtic Name: pyridin-3-yl 4,5-bis(acetyloxymethyl)-2-methyl-dodecanoate hydrochloride Openeye Name: 3-pyridyl 4,5-bis(acetoxymethyl)-2-methyl-dodecanoate hydrochloride CAS Name: 4,5-bis(acetyloxymethyl)-2-methyldodecanoic acid 3-pyridinyl ester hydrochloride IUPAC Name: pyridin-3-yl 4,5-bis(acetyloxymethyl)-2-methyldodecanoate hydrochloride Traditional Name: 4,5-bis(acetoxymethyl)-2-methyl-lauric acid 3-pyridyl ester hydrochloride Formula: C24H38ClNO6 MolecularWeight: 472.01462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(COC(=O)C)C(CC(C)C(=O)OC1=CN=CC=C1)COC(=O)C.Cl

Isomeric SMILES

CCCCCCCC(COC(=O)C)C(CC(C)C(=O)OC1=CN=CC=C1)COC(=O)C.Cl

InChI

InChI=1S/C24H37NO6.ClH/c1-5-6-7-8-9-11-21(16-29-19(3)26)22(17-30-20(4)27)14-18(2)24(28)31-23-12-10-13-25-15-23;/h10,12-13,15,18,21-22H,5-9,11,14,16-17H2,1-4H3;1H