2-[(4-methylphenyl)amino]-5,8-dinitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[(4-methylphenyl)amino]-5,8-dinitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-methylanilino)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-methylanilino)-5,8-dinitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-methylanilino)-5,8-dinitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 5,8-dinitro-2-(p-toluidino)benzo[de]isoquinoline-1,3-quinone Formula: C19H12N4O6 MolecularWeight: 392.32178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NN2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NN2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H12N4O6/c1-10-2-4-12(5-3-10)20-21-18(24)15-8-13(22(26)27)6-11-7-14(23(28)29)9-16(17(11)15)19(21)25/h2-9,20H,1H3