2-[(3-chlorophenyl)amino]-6,7-dinitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[(3-chlorophenyl)amino]-6,7-dinitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(3-chloroanilino)-6,7-dinitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(3-chloroanilino)-6,7-dinitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(3-chloroanilino)-6,7-dinitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(3-chloroanilino)-6,7-dinitro-benzo[de]isoquinoline-1,3-quinone Formula: C18H9ClN4O6 MolecularWeight: 412.74026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NN2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NN2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O

InChI

InChI=1S/C18H9ClN4O6/c19-9-2-1-3-10(8-9)20-21-17(24)11-4-6-13(22(26)27)16-14(23(28)29)7-5-12(15(11)16)18(21)25/h1-8,20H