5-bromanyl-2-(3,5-dimethyl-1H-pyrazol-4-yl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 5-bromanyl-2-(3,5-dimethyl-1H-pyrazol-4-yl)benzo[de]isoquinoline-1,3-dione Openeye Name: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-4-yl)benzo[de]isoquinoline-1,3-dione CAS Name: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-4-yl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-4-yl)benzo[de]isoquinoline-1,3-dione Traditional Name: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-4-yl)benzo[de]isoquinoline-1,3-quinone Formula: C17H12BrN3O2 MolecularWeight: 370.20008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)N2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)Br

Isomeric SMILES

CC1=C(C(=NN1)C)N2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)Br

InChI

InChI=1S/C17H12BrN3O2/c1-8-15(9(2)20-19-8)21-16(22)12-5-3-4-10-6-11(18)7-13(14(10)12)17(21)23/h3-7H,1-2H3,(H,19,20)