2-(3-chlorophenyl)-6-(1H-pyrazol-5-yl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(3-chlorophenyl)-6-(1H-pyrazol-5-yl)benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(3-chlorophenyl)-6-(1H-pyrazol-5-yl)benzo[de]isoquinoline-1,3-dione CAS Name: 2-(3-chlorophenyl)-6-(1H-pyrazol-5-yl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(3-chlorophenyl)-6-(1H-pyrazol-5-yl)benzo[de]isoquinoline-1,3-dione Traditional Name: 2-(3-chlorophenyl)-6-(1H-pyrazol-5-yl)benzo[de]isoquinoline-1,3-quinone Formula: C21H12ClN3O2 MolecularWeight: 373.79188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)N2C(=O)C3=C4C(=C(C=C3)C5=CC=NN5)C=CC=C4C2=O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)N2C(=O)C3=C4C(=C(C=C3)C5=CC=NN5)C=CC=C4C2=O

InChI

InChI=1S/C21H12ClN3O2/c22-12-3-1-4-13(11-12)25-20(26)16-6-2-5-15-14(18-9-10-23-24-18)7-8-17(19(15)16)21(25)27/h1-11H,(H,23,24)