2-heptanoyl-7-heptoxy-4,5-dihydro-[1,2,4]triazolo[4,3-a]quinolin-1-one

Systemtic Name: 2-heptanoyl-7-heptoxy-4,5-dihydro-[1,2,4]triazolo[4,3-a]quinolin-1-one Openeye Name: 2-heptanoyl-7-heptoxy-4,5-dihydro-[1,2,4]triazolo[4,3-a]quinolin-1-one CAS Name: 7-heptoxy-2-(1-oxoheptyl)-4,5-dihydro-[1,2,4]triazolo[4,3-a]quinolin-1-one IUPAC Name: 2-heptanoyl-7-heptoxy-4,5-dihydro-[1,2,4]triazolo[4,3-a]quinolin-1-one Traditional Name: 2-enanthyl-7-heptoxy-4,5-dihydro-[1,2,4]triazolo[4,3-a]quinolin-1-one Formula: C24H35N3O3 MolecularWeight: 413.553

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC2=C(C=C1)N3C(=NN(C3=O)C(=O)CCCCCC)CC2

Isomeric SMILES

CCCCCCCOC1=CC2=C(C=C1)N3C(=NN(C3=O)C(=O)CCCCCC)CC2

InChI

InChI=1S/C24H35N3O3/c1-3-5-7-9-11-17-30-20-14-15-21-19(18-20)13-16-22-25-27(24(29)26(21)22)23(28)12-10-8-6-4-2/h14-15,18H,3-13,16-17H2,1-2H3