N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(3-chloranyl-4-methyl-phenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(3-chloranyl-4-methyl-phenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(3-chloro-4-methyl-phenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(3-chloro-4-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(3-chloro-4-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide Traditional Name: 1-(3-chloro-4-methyl-phenyl)-N-homopiperonyl-6-keto-4,5-dihydropyridazine-3-carboxamide Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)CCC(=N2)C(=O)NCCC3=CC4=C(C=C3)OCO4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)CCC(=N2)C(=O)NCCC3=CC4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C21H20ClN3O4/c1-13-2-4-15(11-16(13)22)25-20(26)7-5-17(24-25)21(27)23-9-8-14-3-6-18-19(10-14)29-12-28-18/h2-4,6,10-11H,5,7-9,12H2,1H3,(H,23,27)