3-azanylidene-6-[(4,6-dimethoxy-1-benzofuran-5-yl)carbonyl]-2-(4-nitrophenyl)pyridazine-4-carbonitrile

Systemtic Name: 3-azanylidene-6-[(4,6-dimethoxy-1-benzofuran-5-yl)carbonyl]-2-(4-nitrophenyl)pyridazine-4-carbonitrile Openeye Name: 6-(4,6-dimethoxybenzofuran-5-carbonyl)-3-imino-2-(4-nitrophenyl)pyridazine-4-carbonitrile CAS Name: 6-[(4,6-dimethoxy-5-benzofuranyl)-oxomethyl]-3-imino-2-(4-nitrophenyl)-4-pyridazinecarbonitrile IUPAC Name: 6-(4,6-dimethoxy-1-benzofuran-5-carbonyl)-3-imino-2-(4-nitrophenyl)pyridazine-4-carbonitrile Traditional Name: 6-(4,6-dimethoxybenzofuran-5-carbonyl)-3-imino-2-(4-nitrophenyl)pyridazine-4-carbonitrile Formula: C22H15N5O6 MolecularWeight: 445.3844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C=COC2=C1)OC)C(=O)C3=NN(C(=N)C(=C3)C#N)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C(=C2C=COC2=C1)OC)C(=O)C3=NN(C(=N)C(=C3)C#N)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15N5O6/c1-31-18-10-17-15(7-8-33-17)21(32-2)19(18)20(28)16-9-12(11-23)22(24)26(25-16)13-3-5-14(6-4-13)27(29)30/h3-10,24H,1-2H3