2-[4-(4-aminophenyl)phenyl]-6-nitro-5-oxidanyl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[4-(4-aminophenyl)phenyl]-6-nitro-5-oxidanyl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[4-(4-aminophenyl)phenyl]-5-hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-[4-(4-aminophenyl)phenyl]-5-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[4-(4-aminophenyl)phenyl]-5-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-[4-(4-aminophenyl)phenyl]-5-hydroxy-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C24H15N3O5 MolecularWeight: 425.393

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC(=C2[N+](=O)[O-])O)C4=CC=C(C=C4)C5=CC=C(C=C5)N

Isomeric SMILES

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC(=C2[N+](=O)[O-])O)C4=CC=C(C=C4)C5=CC=C(C=C5)N

InChI

InChI=1S/C24H15N3O5/c25-15-8-4-13(5-9-15)14-6-10-16(11-7-14)26-23(29)18-3-1-2-17-21(18)19(24(26)30)12-20(28)22(17)27(31)32/h1-12,28H,25H2