oxidanylidene-[[1-[[4-(phenylcarbonyl)pyridin-1-ium-1-yl]methoxymethyl]pyridin-4-ylidene]methyl]azanium

Systemtic Name: oxidanylidene-[[1-[[4-(phenylcarbonyl)pyridin-1-ium-1-yl]methoxymethyl]pyridin-4-ylidene]methyl]azanium Openeye Name: [1-[(4-benzoylpyridin-1-ium-1-yl)methoxymethyl]-4-pyridylidene]methyl-oxo-ammonium CAS Name: [1-[(4-benzoyl-1-pyridin-1-iumyl)methoxymethyl]-4-pyridinylidene]methyl-oxoammonium IUPAC Name: [1-[(4-benzoylpyridin-1-ium-1-yl)methoxymethyl]pyridin-4-ylidene]methyl-oxoazanium Traditional Name: [1-[(4-benzoylpyridin-1-ium-1-yl)methoxymethyl]-4-pyridylidene]methyl-keto-ammonium Formula: C20H19N3O3+2 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=[N+](C=C2)COCN3C=CC(=C[NH+]=O)C=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=[N+](C=C2)COCN3C=CC(=C[NH+]=O)C=C3

InChI

InChI=1S/C20H18N3O3/c24-20(18-4-2-1-3-5-18)19-8-12-23(13-9-19)16-26-15-22-10-6-17(7-11-22)14-21-25/h1-14H,15-16H2/q+1/p+1