N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-6-oxidanylidene-1H-pyridazine-3-carboxamide

Systemtic Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-6-oxidanylidene-1H-pyridazine-3-carboxamide Openeye Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-6-oxo-1H-pyridazine-3-carboxamide CAS Name: N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-6-oxo-1H-pyridazine-3-carboxamide IUPAC Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-6-oxo-1H-pyridazine-3-carboxamide Traditional Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-6-keto-1H-pyridazine-3-carboxamide Formula: C17H27N4O2+ MolecularWeight: 319.42188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH+]2CCCC(C2)NC(=O)C3=NNC(=O)C=C3

Isomeric SMILES

C1CCCC(CC1)[NH+]2CCC[C@@H](C2)NC(=O)C3=NNC(=O)C=C3

InChI

InChI=1S/C17H26N4O2/c22-16-10-9-15(19-20-16)17(23)18-13-6-5-11-21(12-13)14-7-3-1-2-4-8-14/h9-10,13-14H,1-8,11-12H2,(H,18,23)(H,20,22)/p+1/t13-/m0/s1