methyl 2-[3-(4-nitrophenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoate

Systemtic Name: methyl 2-[3-(4-nitrophenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoate Openeye Name: methyl 2-[3-(4-nitrophenyl)-6-oxo-pyridazin-1-yl]acetate CAS Name: 2-[3-(4-nitrophenyl)-6-oxo-1-pyridazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(4-nitrophenyl)-6-oxopyridazin-1-yl]acetate Traditional Name: 2-[6-keto-3-(4-nitrophenyl)pyridazin-1-yl]acetic acid methyl ester Formula: C13H11N3O5 MolecularWeight: 289.24354

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C=CC(=N1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CN1C(=O)C=CC(=N1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O5/c1-21-13(18)8-15-12(17)7-6-11(14-15)9-2-4-10(5-3-9)16(19)20/h2-7H,8H2,1H3