5-[(2,4-dinitrophenyl)amino]-6-[(4-nitrophenyl)amino]isoindole-1,3-dione

Systemtic Name: 5-[(2,4-dinitrophenyl)amino]-6-[(4-nitrophenyl)amino]isoindole-1,3-dione Openeye Name: 5-(2,4-dinitroanilino)-6-(4-nitroanilino)isoindoline-1,3-dione CAS Name: 5-(2,4-dinitroanilino)-6-(4-nitroanilino)isoindole-1,3-dione IUPAC Name: 5-(2,4-dinitroanilino)-6-(4-nitroanilino)isoindole-1,3-dione Traditional Name: 5-(2,4-dinitroanilino)-6-(4-nitroanilino)isoindoline-1,3-quinone Formula: C20H12N6O8 MolecularWeight: 464.34468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C=C3C(=C2)C(=O)NC3=O)NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C=C3C(=C2)C(=O)NC3=O)NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H12N6O8/c27-19-13-8-16(21-10-1-3-11(4-2-10)24(29)30)17(9-14(13)20(28)23-19)22-15-6-5-12(25(31)32)7-18(15)26(33)34/h1-9,21-22H,(H,23,27,28)