N-(1,3-benzodioxol-5-ylmethyl)-3-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCN3C(=O)C=CC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCN3C(=O)C=CC(=N3)C4=CC=CC=C4

InChI

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