N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-ethylphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-ethylphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-ethylphenyl)-6-oxo-pyridazin-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-ethylphenyl)-6-oxo-1-pyridazinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-ethylphenyl)-6-oxopyridazin-1-yl]acetamide Traditional Name: 2-[3-(4-ethylphenyl)-6-keto-pyridazin-1-yl]-N-piperonyl-acetamide Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H21N3O4/c1-2-15-3-6-17(7-4-15)18-8-10-22(27)25(24-18)13-21(26)23-12-16-5-9-19-20(11-16)29-14-28-19/h3-11H,2,12-14H2,1H3,(H,23,26)