6-(3-methylpyridin-1-ium-1-yl)-5,7,8-tris(oxidanyl)naphthalene-1,4-dione

Systemtic Name: 6-(3-methylpyridin-1-ium-1-yl)-5,7,8-tris(oxidanyl)naphthalene-1,4-dione Openeye Name: 5,6,8-trihydroxy-7-(3-methylpyridin-1-ium-1-yl)naphthalene-1,4-dione CAS Name: 5,6,8-trihydroxy-7-(3-methyl-1-pyridin-1-iumyl)naphthalene-1,4-dione IUPAC Name: 5,6,8-trihydroxy-7-(3-methylpyridin-1-ium-1-yl)naphthalene-1,4-dione Traditional Name: 5,6,8-trihydroxy-7-(3-methylpyridin-1-ium-1-yl)-1,4-naphthoquinone Formula: C16H12NO5+ MolecularWeight: 298.27018

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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)/p+1