2-[1,3-dimethyl-2,5-bis(oxidanylidene)pyrrol-1-ium-1-yl]benzene-1,3-dicarboxylic acid

Systemtic Name: 2-[1,3-dimethyl-2,5-bis(oxidanylidene)pyrrol-1-ium-1-yl]benzene-1,3-dicarboxylic acid Openeye Name: 2-(1,3-dimethyl-2,5-dioxo-pyrrol-1-ium-1-yl)benzene-1,3-dicarboxylic acid CAS Name: 2-(1,3-dimethyl-2,5-dioxo-1-pyrrol-1-iumyl)benzene-1,3-dicarboxylic acid IUPAC Name: 2-(1,3-dimethyl-2,5-dioxopyrrol-1-ium-1-yl)benzene-1,3-dicarboxylic acid Traditional Name: 2-(2,5-diketo-1,3-dimethyl-3-pyrrolin-1-ium-1-yl)isophthalic acid Formula: C14H12NO6+ MolecularWeight: 290.24818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)[N+](C1=O)(C)C2=C(C=CC=C2C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=O)[N+](C1=O)(C)C2=C(C=CC=C2C(=O)O)C(=O)O

InChI

InChI=1S/C14H11NO6/c1-7-6-10(16)15(2,12(7)17)11-8(13(18)19)4-3-5-9(11)14(20)21/h3-6H,1-2H3,(H-,18,19,20,21)/p+1