2-chloranyl-N-[(1-oxidanylcycloheptyl)methyl]-5-(6-oxidanylidene-1H-pyridazin-3-yl)benzamide

Systemtic Name: 2-chloranyl-N-[(1-oxidanylcycloheptyl)methyl]-5-(6-oxidanylidene-1H-pyridazin-3-yl)benzamide Openeye Name: 2-chloro-N-[(1-hydroxycycloheptyl)methyl]-5-(6-oxo-1H-pyridazin-3-yl)benzamide CAS Name: 2-chloro-N-[(1-hydroxycycloheptyl)methyl]-5-(6-oxo-1H-pyridazin-3-yl)benzamide IUPAC Name: 2-chloro-N-[(1-hydroxycycloheptyl)methyl]-5-(6-oxo-1H-pyridazin-3-yl)benzamide Traditional Name: 2-chloro-N-[(1-hydroxycycloheptyl)methyl]-5-(6-keto-1H-pyridazin-3-yl)benzamide Formula: C19H22ClN3O3 MolecularWeight: 375.84928

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CNC(=O)C2=C(C=CC(=C2)C3=NNC(=O)C=C3)Cl)O

Isomeric SMILES

C1CCCC(CC1)(CNC(=O)C2=C(C=CC(=C2)C3=NNC(=O)C=C3)Cl)O

InChI

InChI=1S/C19H22ClN3O3/c20-15-6-5-13(16-7-8-17(24)23-22-16)11-14(15)18(25)21-12-19(26)9-3-1-2-4-10-19/h5-8,11,26H,1-4,9-10,12H2,(H,21,25)(H,23,24)