1-[[4-nitro-5-(pyridin-2-ylamino)-2,1,3-benzoxadiazol-7-yl]amino]anthracene-9,10-dione

Systemtic Name: 1-[[4-nitro-5-(pyridin-2-ylamino)-2,1,3-benzoxadiazol-7-yl]amino]anthracene-9,10-dione Openeye Name: 1-[[4-nitro-5-(2-pyridylamino)-2,1,3-benzoxadiazol-7-yl]amino]anthracene-9,10-dione CAS Name: 1-[[4-nitro-5-(2-pyridinylamino)-2,1,3-benzoxadiazol-7-yl]amino]anthracene-9,10-dione IUPAC Name: 1-[[4-nitro-5-(pyridin-2-ylamino)-2,1,3-benzoxadiazol-7-yl]amino]anthracene-9,10-dione Traditional Name: 1-[[7-nitro-6-(2-pyridylamino)benzofurazan-4-yl]amino]-9,10-anthraquinone Formula: C25H14N6O5 MolecularWeight: 478.41586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=CC(=C(C5=NON=C45)[N+](=O)[O-])NC6=CC=CC=N6

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=CC(=C(C5=NON=C45)[N+](=O)[O-])NC6=CC=CC=N6

InChI

InChI=1S/C25H14N6O5/c32-24-13-6-1-2-7-14(13)25(33)20-15(24)8-5-9-16(20)27-17-12-18(28-19-10-3-4-11-26-19)23(31(34)35)22-21(17)29-36-30-22/h1-12,27H,(H,26,28)