6-bromanyl-2-[(3-methylphenyl)amino]-5-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-bromanyl-2-[(3-methylphenyl)amino]-5-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 6-bromo-2-(3-methylanilino)-5-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 6-bromo-2-(3-methylanilino)-5-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 6-bromo-2-(3-methylanilino)-5-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 6-bromo-2-(m-toluidino)-5-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C19H12BrN3O4 MolecularWeight: 426.22028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NN2C(=O)C3=CC=CC4=C3C(=CC(=C4Br)[N+](=O)[O-])C2=O

Isomeric SMILES

CC1=CC(=CC=C1)NN2C(=O)C3=CC=CC4=C3C(=CC(=C4Br)[N+](=O)[O-])C2=O

InChI

InChI=1S/C19H12BrN3O4/c1-10-4-2-5-11(8-10)21-22-18(24)13-7-3-6-12-16(13)14(19(22)25)9-15(17(12)20)23(26)27/h2-9,21H,1H3