[4-(2-azanyl-3-methyl-pentanoyl)oxy-2-methyl-butyl] docosanoate

Systemtic Name: [4-(2-azanyl-3-methyl-pentanoyl)oxy-2-methyl-butyl] docosanoate Openeye Name: [4-(2-amino-3-methyl-pentanoyl)oxy-2-methyl-butyl] docosanoate CAS Name: docosanoic acid [4-(2-amino-3-methyl-1-oxopentoxy)-2-methylbutyl] ester IUPAC Name: [4-(2-amino-3-methylpentanoyl)oxy-2-methylbutyl] docosanoate Traditional Name: behenic acid [4-(2-amino-3-methyl-pentanoyl)oxy-2-methyl-butyl] ester Formula: C33H65NO4 MolecularWeight: 539.8735

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(C)CCOC(=O)C(C(C)CC)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(C)CCOC(=O)C(C(C)CC)N

InChI

InChI=1S/C33H65NO4/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-31(35)38-28-29(3)26-27-37-33(36)32(34)30(4)6-2/h29-30,32H,5-28,34H2,1-4H3