1-(5-methyl-7-oxidanylidene-3,6-dihydro-2H-1,4-diazepin-1-yl)ethyl octanoate

Systemtic Name: 1-(5-methyl-7-oxidanylidene-3,6-dihydro-2H-1,4-diazepin-1-yl)ethyl octanoate Openeye Name: 1-(5-methyl-7-oxo-3,6-dihydro-2H-1,4-diazepin-1-yl)ethyl octanoate CAS Name: octanoic acid 1-(5-methyl-7-oxo-3,6-dihydro-2H-1,4-diazepin-1-yl)ethyl ester IUPAC Name: 1-(5-methyl-7-oxo-3,6-dihydro-2H-1,4-diazepin-1-yl)ethyl octanoate Traditional Name: caprylic acid 1-(7-keto-5-methyl-3,6-dihydro-2H-1,4-diazepin-1-yl)ethyl ester Formula: C16H28N2O3 MolecularWeight: 296.40512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(C)N1CCN=C(CC1=O)C

Isomeric SMILES

CCCCCCCC(=O)OC(C)N1CCN=C(CC1=O)C

InChI

InChI=1S/C16H28N2O3/c1-4-5-6-7-8-9-16(20)21-14(3)18-11-10-17-13(2)12-15(18)19/h14H,4-12H2,1-3H3