2-(4-butylphenyl)-6-chloranyl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(4-butylphenyl)-6-chloranyl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-butylphenyl)-6-chloro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-butylphenyl)-6-chlorobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-butylphenyl)-6-chlorobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(4-butylphenyl)-6-chloro-benzo[de]isoquinoline-1,3-quinone Formula: C22H18ClNO2 MolecularWeight: 363.83682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C3=C4C(=C(C=C3)Cl)C=CC=C4C2=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C3=C4C(=C(C=C3)Cl)C=CC=C4C2=O

InChI

InChI=1S/C22H18ClNO2/c1-2-3-5-14-8-10-15(11-9-14)24-21(25)17-7-4-6-16-19(23)13-12-18(20(16)17)22(24)26/h4,6-13H,2-3,5H2,1H3