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

Systemtic Name: 3-[[3-methoxy-5-nitro-4-(5-nitropyridin-2-yl)oxy-phenyl]methylideneamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[[3-methoxy-5-nitro-4-[(5-nitro-2-pyridyl)oxy]phenyl]methyleneamino]-1H-quinazoline-2,4-dione CAS Name: 3-[[3-methoxy-5-nitro-4-[(5-nitro-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[[3-methoxy-5-nitro-4-(5-nitropyridin-2-yl)oxyphenyl]methylideneamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[[3-methoxy-5-nitro-4-[(5-nitro-2-pyridyl)oxy]benzylidene]amino]-1H-quinazoline-2,4-quinone Formula: C21H14N6O8 MolecularWeight: 478.37126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC2=NC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C=NN3C(=O)C4=CC=CC=C4NC3=O

Isomeric SMILES

COC1=CC(=CC(=C1OC2=NC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C=NN3C(=O)C4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H14N6O8/c1-34-17-9-12(10-23-25-20(28)14-4-2-3-5-15(14)24-21(25)29)8-16(27(32)33)19(17)35-18-7-6-13(11-22-18)26(30)31/h2-11H,1H3,(H,24,29)