4,6-bis[(4-methylimidazol-1-yl)carbonyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 4,6-bis[(4-methylimidazol-1-yl)carbonyl]benzene-1,3-dicarboxylic acid Openeye Name: 4,6-bis(4-methylimidazole-1-carbonyl)benzene-1,3-dicarboxylic acid CAS Name: 4,6-bis[(4-methyl-1-imidazolyl)-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4,6-bis(4-methylimidazole-1-carbonyl)benzene-1,3-dicarboxylic acid Traditional Name: 4,6-bis(4-methylimidazole-1-carbonyl)isophthalic acid Formula: C18H14N4O6 MolecularWeight: 382.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)C(=O)C2=CC(=C(C=C2C(=O)O)C(=O)O)C(=O)N3C=C(N=C3)C

Isomeric SMILES

CC1=CN(C=N1)C(=O)C2=CC(=C(C=C2C(=O)O)C(=O)O)C(=O)N3C=C(N=C3)C

InChI

InChI=1S/C18H14N4O6/c1-9-5-21(7-19-9)15(23)11-3-12(16(24)22-6-10(2)20-8-22)14(18(27)28)4-13(11)17(25)26/h3-8H,1-2H3,(H,25,26)(H,27,28)