3-isocyano-4-(1-oxidanyl-3-oxidanylidene-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-2-yl)benzenecarbonitrile

Systemtic Name: 3-isocyano-4-(1-oxidanyl-3-oxidanylidene-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-2-yl)benzenecarbonitrile Openeye Name: 4-(1-hydroxy-3-oxo-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-2-yl)-3-isocyano-benzonitrile CAS Name: 4-(1-hydroxy-3-oxo-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-2-yl)-3-isocyanobenzonitrile IUPAC Name: 4-(1-hydroxy-3-oxo-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-2-yl)-3-isocyanobenzonitrile Traditional Name: 4-(1-hydroxy-3-keto-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-2-yl)-3-isocyano-benzonitrile Formula: C15H12N4O2 MolecularWeight: 280.28138

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=C(C=CC(=C1)C#N)C2=C(N3CCCCN3C2=O)O

Isomeric SMILES

[C-]#[N+]C1=C(C=CC(=C1)C#N)C2=C(N3CCCCN3C2=O)O

InChI

InChI=1S/C15H12N4O2/c1-17-12-8-10(9-16)4-5-11(12)13-14(20)18-6-2-3-7-19(18)15(13)21/h4-5,8,20H,2-3,6-7H2