(3Z,5E)-1-methyl-3,5-bis(pyridin-4-ylmethylidene)piperidin-1-ium-4-one

Systemtic Name: (3Z,5E)-1-methyl-3,5-bis(pyridin-4-ylmethylidene)piperidin-1-ium-4-one Openeye Name: (3Z,5E)-1-methyl-3,5-bis(4-pyridylmethylene)piperidin-1-ium-4-one CAS Name: (3Z,5E)-1-methyl-3,5-bis(pyridin-4-ylmethylidene)-4-piperidin-1-iumone IUPAC Name: (3Z,5E)-1-methyl-3,5-bis(pyridin-4-ylmethylidene)piperidin-1-ium-4-one Traditional Name: (3Z,5E)-1-methyl-3,5-bis(4-pyridylmethylene)piperidin-1-ium-4-one Formula: C18H18N3O+ MolecularWeight: 292.35502

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC(=CC2=CC=NC=C2)C(=O)C(=CC3=CC=NC=C3)C1

Isomeric SMILES

C[NH+]1C/C(=C\C2=CC=NC=C2)/C(=O)/C(=C\C3=CC=NC=C3)/C1

InChI

InChI=1S/C18H17N3O/c1-21-12-16(10-14-2-6-19-7-3-14)18(22)17(13-21)11-15-4-8-20-9-5-15/h2-11H,12-13H2,1H3/p+1/b16-10-,17-11+