6-oxidanylidene-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]-4,5-dihydro-1H-pyridazine-3-carboxamide

Systemtic Name: 6-oxidanylidene-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]-4,5-dihydro-1H-pyridazine-3-carboxamide Openeye Name: 6-oxo-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]-4,5-dihydro-1H-pyridazine-3-carboxamide CAS Name: 6-oxo-N-[(3S)-1-(3-phenylpropyl)-3-piperidin-1-iumyl]-4,5-dihydro-1H-pyridazine-3-carboxamide IUPAC Name: 6-oxo-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]-4,5-dihydro-1H-pyridazine-3-carboxamide Traditional Name: 6-keto-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]-4,5-dihydro-1H-pyridazine-3-carboxamide Formula: C19H27N4O2+ MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCCC2=CC=CC=C2)NC(=O)C3=NNC(=O)CC3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CCCC2=CC=CC=C2)NC(=O)C3=NNC(=O)CC3

InChI

InChI=1S/C19H26N4O2/c24-18-11-10-17(21-22-18)19(25)20-16-9-5-13-23(14-16)12-4-8-15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14H2,(H,20,25)(H,22,24)/p+1/t16-/m0/s1