2-(3-methylpyridin-1-ium-1-yl)-3,4-bis(oxidanyl)-5,8-bis(oxidanylidene)naphthalen-1-olate

Systemtic Name: 2-(3-methylpyridin-1-ium-1-yl)-3,4-bis(oxidanyl)-5,8-bis(oxidanylidene)naphthalen-1-olate Openeye Name: 3,4-dihydroxy-2-(3-methylpyridin-1-ium-1-yl)-5,8-dioxo-naphthalen-1-olate CAS Name: 3,4-dihydroxy-2-(3-methyl-1-pyridin-1-iumyl)-5,8-dioxo-1-naphthalenolate IUPAC Name: 3,4-dihydroxy-2-(3-methylpyridin-1-ium-1-yl)-5,8-dioxonaphthalen-1-olate Traditional Name: 3,4-dihydroxy-5,8-diketo-2-(3-methylpyridin-1-ium-1-yl)naphthalen-1-olate Formula: C16H11NO5 MolecularWeight: 297.26224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C2=C(C3=C(C(=O)C=CC3=O)C(=C2O)O)[O-]

Isomeric SMILES

CC1=C[N+](=CC=C1)C2=C(C3=C(C(=O)C=CC3=O)C(=C2O)O)[O-]

InChI

InChI=1S/C16H11NO5/c1-8-3-2-6-17(7-8)13-14(20)11-9(18)4-5-10(19)12(11)15(21)16(13)22/h2-7H,1H3,(H2-,18,19,20,21,22)