2,2-dibutyl-10-oxidanylidene-10-(1-oxidanyl-1-oxidanylidene-octan-2-yl)oxy-decanoate; 1-dodecylazepan-2-one

Systemtic Name: 2,2-dibutyl-10-oxidanylidene-10-(1-oxidanyl-1-oxidanylidene-octan-2-yl)oxy-decanoate; 1-dodecylazepan-2-one Openeye Name: 2,2-dibutyl-10-(1-carboxyheptoxy)-10-oxo-decanoate; 1-dodecylazepan-2-one CAS Name: 2,2-dibutyl-10-(1-hydroxy-1-oxooctan-2-yl)oxy-10-oxodecanoate; 1-dodecyl-2-azepanone IUPAC Name: 2,2-dibutyl-10-(1-hydroxy-1-oxooctan-2-yl)oxy-10-oxodecanoate; 1-dodecylazepan-2-one Traditional Name: 2,2-dibutyl-10-(1-carboxyheptoxy)-10-keto-caprate; 1-laurylazepan-2-one Formula: C44H82NO7- MolecularWeight: 737.12438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1CCCCCC1=O.CCCCCCC(C(=O)O)OC(=O)CCCCCCCC(CCCC)(CCCC)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCN1CCCCCC1=O.CCCCCCC(C(=O)O)OC(=O)CCCCCCCC(CCCC)(CCCC)C(=O)[O-]

InChI

InChI=1S/C26H48O6.C18H35NO/c1-4-7-10-14-17-22(24(28)29)32-23(27)18-15-12-11-13-16-21-26(25(30)31,19-8-5-2)20-9-6-3;1-2-3-4-5-6-7-8-9-10-13-16-19-17-14-11-12-15-18(19)20/h22H,4-21H2,1-3H3,(H,28,29)(H,30,31);2-17H2,1H3/p-1