2,6-bis(pyridin-1-ium-3-ylmethylidene)cyclohexan-1-one

Systemtic Name: 2,6-bis(pyridin-1-ium-3-ylmethylidene)cyclohexan-1-one Openeye Name: 2,6-bis(pyridin-1-ium-3-ylmethylene)cyclohexanone CAS Name: 2,6-bis(3-pyridin-1-iumylmethylidene)-1-cyclohexanone IUPAC Name: 2,6-bis(pyridin-1-ium-3-ylmethylidene)cyclohexan-1-one Traditional Name: 2,6-bis(pyridin-1-ium-3-ylmethylene)cyclohexanone Formula: C18H18N2O+2 MolecularWeight: 278.34832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=C[NH+]=CC=C2)C(=O)C(=CC3=C[NH+]=CC=C3)C1

Isomeric SMILES

C1CC(=CC2=C[NH+]=CC=C2)C(=O)C(=CC3=C[NH+]=CC=C3)C1

InChI

InChI=1S/C18H16N2O/c21-18-16(10-14-4-2-8-19-12-14)6-1-7-17(18)11-15-5-3-9-20-13-15/h2-5,8-13H,1,6-7H2/p+2