2-butyl-5-(4-phenyl-1,2,3-triazol-1-yl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-butyl-5-(4-phenyl-1,2,3-triazol-1-yl)benzo[de]isoquinoline-1,3-dione Openeye Name: 2-butyl-5-(4-phenyltriazol-1-yl)benzo[de]isoquinoline-1,3-dione CAS Name: 2-butyl-5-(4-phenyl-1-triazolyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-butyl-5-(4-phenyltriazol-1-yl)benzo[de]isoquinoline-1,3-dione Traditional Name: 2-butyl-5-(4-phenyltriazol-1-yl)benzo[de]isoquinoline-1,3-quinone Formula: C24H20N4O2 MolecularWeight: 396.4412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)N4C=C(N=N4)C5=CC=CC=C5

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)N4C=C(N=N4)C5=CC=CC=C5

InChI

InChI=1S/C24H20N4O2/c1-2-3-12-27-23(29)19-11-7-10-17-13-18(14-20(22(17)19)24(27)30)28-15-21(25-26-28)16-8-5-4-6-9-16/h4-11,13-15H,2-3,12H2,1H3