1-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,2,3,6-tetrahydropyridin-1-ium-5-carboxamide

Systemtic Name: 1-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,2,3,6-tetrahydropyridin-1-ium-5-carboxamide Openeye Name: 1-methyl-N-[(Z)-3-pyridylmethyleneamino]-1,2,3,6-tetrahydropyridin-1-ium-5-carboxamide CAS Name: 1-methyl-N-[(Z)-3-pyridinylmethylideneamino]-1,2,3,6-tetrahydropyridin-1-ium-5-carboxamide IUPAC Name: 1-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,2,3,6-tetrahydropyridin-1-ium-5-carboxamide Traditional Name: 1-methyl-N-[(Z)-3-pyridylmethyleneamino]-1,2,3,6-tetrahydropyridin-1-ium-5-carboxamide Formula: C13H17N4O+ MolecularWeight: 245.30028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC=C(C1)C(=O)NN=CC2=CN=CC=C2

Isomeric SMILES

C[NH+]1CCC=C(C1)C(=O)N/N=C\C2=CN=CC=C2

InChI

InChI=1S/C13H16N4O/c1-17-7-3-5-12(10-17)13(18)16-15-9-11-4-2-6-14-8-11/h2,4-6,8-9H,3,7,10H2,1H3,(H,16,18)/p+1/b15-9-