ethyl 7-(8-oxidanylidene-4,7-dihydroimidazo[4,5-d][1,3]diazepin-1-yl)heptanoate

Systemtic Name: ethyl 7-(8-oxidanylidene-4,7-dihydroimidazo[4,5-d][1,3]diazepin-1-yl)heptanoate Openeye Name: ethyl 7-(8-oxo-4,7-dihydroimidazo[4,5-d][1,3]diazepin-1-yl)heptanoate CAS Name: 7-(8-oxo-4,7-dihydroimidazo[4,5-d][1,3]diazepin-1-yl)heptanoic acid ethyl ester IUPAC Name: ethyl 7-(8-oxo-4,7-dihydroimidazo[4,5-d][1,3]diazepin-1-yl)heptanoate Traditional Name: 7-(8-keto-4,7-dihydroimidazo[4,5-d][1,3]diazepin-1-yl)enanthic acid ethyl ester Formula: C15H22N4O3 MolecularWeight: 306.36018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCN1C=NC2=C1C(=O)CN=CN2

Isomeric SMILES

CCOC(=O)CCCCCCN1C=NC2=C1C(=O)CN=CN2

InChI

InChI=1S/C15H22N4O3/c1-2-22-13(21)7-5-3-4-6-8-19-11-18-15-14(19)12(20)9-16-10-17-15/h10-11H,2-9H2,1H3,(H,16,17)