[4,8-bis(oxidanyl)-5,6-bis(oxidanylidene)-7-pyridin-1-ium-1-yl-naphthalen-1-yl] ethanoate

Systemtic Name: [4,8-bis(oxidanyl)-5,6-bis(oxidanylidene)-7-pyridin-1-ium-1-yl-naphthalen-1-yl] ethanoate Openeye Name: (4,8-dihydroxy-5,6-dioxo-7-pyridin-1-ium-1-yl-1-naphthyl) acetate CAS Name: acetic acid [4,8-dihydroxy-5,6-dioxo-7-(1-pyridin-1-iumyl)-1-naphthalenyl] ester IUPAC Name: (4,8-dihydroxy-5,6-dioxo-7-pyridin-1-ium-1-ylnaphthalen-1-yl) acetate Traditional Name: acetic acid (4,8-dihydroxy-5,6-diketo-7-pyridin-1-ium-1-yl-1-naphthyl) ester Formula: C17H12NO6+ MolecularWeight: 326.28028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C2C(=C(C=C1)O)C(=O)C(=O)C(=C2O)[N+]3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1=C2C(=C(C=C1)O)C(=O)C(=O)C(=C2O)[N+]3=CC=CC=C3

InChI

InChI=1S/C17H11NO6/c1-9(19)24-11-6-5-10(20)12-13(11)15(21)14(17(23)16(12)22)18-7-3-2-4-8-18/h2-8H,1H3,(H-,20,21,22,23)/p+1