N-[3-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)propyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)propyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-(6-oxo-3-phenyl-pyridazin-1-yl)propyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-(6-oxo-3-phenyl-1-pyridazinyl)propyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(6-oxo-3-phenylpyridazin-1-yl)propyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-(6-keto-3-phenyl-pyridazin-1-yl)propyl]-piperonylamide Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCCCN3C(=O)C=CC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCCCN3C(=O)C=CC(=N3)C4=CC=CC=C4

InChI

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