N'-[(1-methylpiperidin-1-ium-4-ylidene)amino]-N-(pyridin-3-ylmethyl)propanediamide

Systemtic Name: N'-[(1-methylpiperidin-1-ium-4-ylidene)amino]-N-(pyridin-3-ylmethyl)propanediamide Openeye Name: N'-[(1-methylpiperidin-1-ium-4-ylidene)amino]-N-(3-pyridylmethyl)propanediamide CAS Name: N'-[(1-methyl-4-piperidin-1-iumylidene)amino]-N-(3-pyridinylmethyl)propanediamide IUPAC Name: N'-[(1-methylpiperidin-1-ium-4-ylidene)amino]-N-(pyridin-3-ylmethyl)propanediamide Traditional Name: N'-[(1-methylpiperidin-1-ium-4-ylidene)amino]-N-(3-pyridylmethyl)malonamide Formula: C15H22N5O2+ MolecularWeight: 304.36748

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(=NNC(=O)CC(=O)NCC2=CN=CC=C2)CC1

Isomeric SMILES

C[NH+]1CCC(=NNC(=O)CC(=O)NCC2=CN=CC=C2)CC1

InChI

InChI=1S/C15H21N5O2/c1-20-7-4-13(5-8-20)18-19-15(22)9-14(21)17-11-12-3-2-6-16-10-12/h2-3,6,10H,4-5,7-9,11H2,1H3,(H,17,21)(H,19,22)/p+1