2-(1-docosanoylpiperidin-2-yl)ethyl 4-methylpiperazine-1-carboxylate hydrochloride

Systemtic Name: 2-(1-docosanoylpiperidin-2-yl)ethyl 4-methylpiperazine-1-carboxylate hydrochloride Openeye Name: 2-(1-docosanoyl-2-piperidyl)ethyl 4-methylpiperazine-1-carboxylate hydrochloride CAS Name: 4-methyl-1-piperazinecarboxylic acid 2-[1-(1-oxodocosyl)-2-piperidinyl]ethyl ester hydrochloride IUPAC Name: 2-(1-docosanoylpiperidin-2-yl)ethyl 4-methylpiperazine-1-carboxylate hydrochloride Traditional Name: 4-methylpiperazine-1-carboxylic acid 2-(1-docosanoyl-2-piperidyl)ethyl ester hydrochloride Formula: C35H68ClN3O3 MolecularWeight: 614.38572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)N1CCCCC1CCOC(=O)N2CCN(CC2)C.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)N1CCCCC1CCOC(=O)N2CCN(CC2)C.Cl

InChI

InChI=1S/C35H67N3O3.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-34(39)38-27-23-22-24-33(38)26-32-41-35(40)37-30-28-36(2)29-31-37;/h33H,3-32H2,1-2H3;1H