N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-chlorophenyl)-6-methyl-4-oxo-pyridazine-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-chlorophenyl)-6-methyl-4-oxo-3-pyridazinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-chlorophenyl)-6-methyl-4-oxopyridazine-3-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-homopiperonyl-4-keto-6-methyl-pyridazine-3-carboxamide Formula: C21H18ClN3O4 MolecularWeight: 411.83832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=C(C=C2)Cl)C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=C(C=C2)Cl)C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H18ClN3O4/c1-13-10-17(26)20(24-25(13)16-5-3-15(22)4-6-16)21(27)23-9-8-14-2-7-18-19(11-14)29-12-28-18/h2-7,10-11H,8-9,12H2,1H3,(H,23,27)