(2E,6S)-2-[(1-methylpyridin-1-ium-4-yl)methylidene]-6-[(1-methylpyridin-4-ylidene)methyl]cyclohexan-1-one

Systemtic Name: (2E,6S)-2-[(1-methylpyridin-1-ium-4-yl)methylidene]-6-[(1-methylpyridin-4-ylidene)methyl]cyclohexan-1-one Openeye Name: (2E,6S)-2-[(1-methylpyridin-1-ium-4-yl)methylene]-6-[(1-methyl-4-pyridylidene)methyl]cyclohexanone CAS Name: (2E,6S)-2-[(1-methyl-4-pyridin-1-iumyl)methylidene]-6-[(1-methyl-4-pyridinylidene)methyl]-1-cyclohexanone IUPAC Name: (2E,6S)-2-[(1-methylpyridin-1-ium-4-yl)methylidene]-6-[(1-methylpyridin-4-ylidene)methyl]cyclohexan-1-one Traditional Name: (2E,6S)-2-[(1-methylpyridin-1-ium-4-yl)methylene]-6-[(1-methyl-4-pyridylidene)methyl]cyclohexanone Formula: C20H23N2O+ MolecularWeight: 307.40942

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=CC2CCCC(=CC3=CC=[N+](C=C3)C)C2=O)C=C1

Isomeric SMILES

CN1C=CC(=C[C@@H]2CCC/C(=C\C3=CC=[N+](C=C3)C)/C2=O)C=C1

InChI

InChI=1S/C20H23N2O/c1-21-10-6-16(7-11-21)14-18-4-3-5-19(20(18)23)15-17-8-12-22(2)13-9-17/h6-15,18H,3-5H2,1-2H3/q+1/b19-15+/t18-/m0/s1