N-(1,3-benzodioxol-5-yl)-4-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)butanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)butanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-(6-oxo-3-phenyl-pyridazin-1-yl)butanamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-(6-oxo-3-phenyl-1-pyridazinyl)butanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-(6-oxo-3-phenylpyridazin-1-yl)butanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-(6-keto-3-phenyl-pyridazin-1-yl)butyramide Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CCCN3C(=O)C=CC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CCCN3C(=O)C=CC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O4/c25-20(22-16-8-10-18-19(13-16)28-14-27-18)7-4-12-24-21(26)11-9-17(23-24)15-5-2-1-3-6-15/h1-3,5-6,8-11,13H,4,7,12,14H2,(H,22,25)