1-(7-methyl-8-oxidanylidene-1,2,3,4-tetrahydro-1,5-diazocin-7-yl)propyl docosanoate

Systemtic Name: 1-(7-methyl-8-oxidanylidene-1,2,3,4-tetrahydro-1,5-diazocin-7-yl)propyl docosanoate Openeye Name: 1-(7-methyl-8-oxo-1,2,3,4-tetrahydro-1,5-diazocin-7-yl)propyl docosanoate CAS Name: docosanoic acid 1-(7-methyl-8-oxo-1,2,3,4-tetrahydro-1,5-diazocin-7-yl)propyl ester IUPAC Name: 1-(7-methyl-8-oxo-1,2,3,4-tetrahydro-1,5-diazocin-7-yl)propyl docosanoate Traditional Name: behenic acid 1-(8-keto-7-methyl-1,2,3,4-tetrahydro-1,5-diazocin-7-yl)propyl ester Formula: C32H60N2O3 MolecularWeight: 520.8304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(CC)C1(C=NCCCNC1=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(CC)C1(C=NCCCNC1=O)C

InChI

InChI=1S/C32H60N2O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-30(35)37-29(5-2)32(3)28-33-26-24-27-34-31(32)36/h28-29H,4-27H2,1-3H3,(H,34,36)