3-[[3-nitro-4-(5-nitropyridin-2-yl)oxy-phenyl]methylideneamino]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[[3-nitro-4-(5-nitropyridin-2-yl)oxy-phenyl]methylideneamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[[3-nitro-4-[(5-nitro-2-pyridyl)oxy]phenyl]methyleneamino]-1H-quinazoline-2,4-dione CAS Name: 3-[[3-nitro-4-[(5-nitro-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[[3-nitro-4-(5-nitropyridin-2-yl)oxyphenyl]methylideneamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[[3-nitro-4-[(5-nitro-2-pyridyl)oxy]benzylidene]amino]-1H-quinazoline-2,4-quinone Formula: C20H12N6O7 MolecularWeight: 448.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)N=CC3=CC(=C(C=C3)OC4=NC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)N=CC3=CC(=C(C=C3)OC4=NC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H12N6O7/c27-19-14-3-1-2-4-15(14)23-20(28)24(19)22-10-12-5-7-17(16(9-12)26(31)32)33-18-8-6-13(11-21-18)25(29)30/h1-11H,(H,23,28)