1-dodecylazepan-2-one; 2,3,4,5,6,7-hexamethylidenedodecanamide

Systemtic Name: 1-dodecylazepan-2-one; 2,3,4,5,6,7-hexamethylidenedodecanamide Openeye Name: 1-dodecylazepan-2-one; 2,3,4,5,6,7-hexamethylenedodecanamide CAS Name: 1-dodecyl-2-azepanone; 2,3,4,5,6,7-hexamethylenedodecanamide IUPAC Name: 1-dodecylazepan-2-one; 2,3,4,5,6,7-hexamethylidenedodecanamide Traditional Name: 7-amyl-2,3,4,5,6-pentamethylene-oct-7-enamide; 1-laurylazepan-2-one Formula: C36H60N2O2 MolecularWeight: 552.8738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1CCCCCC1=O.CCCCCC(=C)C(=C)C(=C)C(=C)C(=C)C(=C)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCN1CCCCCC1=O.CCCCCC(=C)C(=C)C(=C)C(=C)C(=C)C(=C)C(=O)N

InChI

InChI=1S/C18H35NO.C18H25NO/c1-2-3-4-5-6-7-8-9-10-13-16-19-17-14-11-12-15-18(19)20;1-8-9-10-11-12(2)13(3)14(4)15(5)16(6)17(7)18(19)20/h2-17H2,1H3;2-11H2,1H3,(H2,19,20)