N-(1,3-benzodioxol-5-yl)-1-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)isonipecotamide Formula: C23H21ClN4O4 MolecularWeight: 452.89024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C4=C(C(=O)N(N=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C4=C(C(=O)N(N=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C23H21ClN4O4/c24-21-18(13-25-28(23(21)30)17-4-2-1-3-5-17)27-10-8-15(9-11-27)22(29)26-16-6-7-19-20(12-16)32-14-31-19/h1-7,12-13,15H,8-11,14H2,(H,26,29)