2-(4-hydroxyphenyl)-6-[(2-methoxy-4-nitro-phenyl)amino]-5-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(4-hydroxyphenyl)-6-[(2-methoxy-4-nitro-phenyl)amino]-5-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-hydroxyphenyl)-6-(2-methoxy-4-nitro-anilino)-5-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-hydroxyphenyl)-6-(2-methoxy-4-nitroanilino)-5-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-hydroxyphenyl)-6-(2-methoxy-4-nitroanilino)-5-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(4-hydroxyphenyl)-6-(2-methoxy-4-nitro-anilino)-5-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C25H16N4O8 MolecularWeight: 500.41654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC2=C(C=C3C4=C2C=CC=C4C(=O)N(C3=O)C5=CC=C(C=C5)O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC2=C(C=C3C4=C2C=CC=C4C(=O)N(C3=O)C5=CC=C(C=C5)O)[N+](=O)[O-]

InChI

InChI=1S/C25H16N4O8/c1-37-21-11-14(28(33)34)7-10-19(21)26-23-16-3-2-4-17-22(16)18(12-20(23)29(35)36)25(32)27(24(17)31)13-5-8-15(30)9-6-13/h2-12,26,30H,1H3