1-(6-methyl-8-oxidanylidene-2,3,4,7-tetrahydro-1H-1,5-diazocin-7-yl)ethyl dodecanoate

Systemtic Name: 1-(6-methyl-8-oxidanylidene-2,3,4,7-tetrahydro-1H-1,5-diazocin-7-yl)ethyl dodecanoate Openeye Name: 1-(6-methyl-8-oxo-2,3,4,7-tetrahydro-1H-1,5-diazocin-7-yl)ethyl dodecanoate CAS Name: dodecanoic acid 1-(6-methyl-8-oxo-2,3,4,7-tetrahydro-1H-1,5-diazocin-7-yl)ethyl ester IUPAC Name: 1-(6-methyl-8-oxo-2,3,4,7-tetrahydro-1H-1,5-diazocin-7-yl)ethyl dodecanoate Traditional Name: lauric acid 1-(8-keto-6-methyl-2,3,4,7-tetrahydro-1H-1,5-diazocin-7-yl)ethyl ester Formula: C21H38N2O3 MolecularWeight: 366.53802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC(C)C1C(=NCCCNC1=O)C

Isomeric SMILES

CCCCCCCCCCCC(=O)OC(C)C1C(=NCCCNC1=O)C

InChI

InChI=1S/C21H38N2O3/c1-4-5-6-7-8-9-10-11-12-14-19(24)26-18(3)20-17(2)22-15-13-16-23-21(20)25/h18,20H,4-16H2,1-3H3,(H,23,25)