5-methyl-1,10-bis(oxidanylidene)-4,7-dihydro-4,7-phenanthroline-3,8-dicarboxylic acid

Systemtic Name: 5-methyl-1,10-bis(oxidanylidene)-4,7-dihydro-4,7-phenanthroline-3,8-dicarboxylic acid Openeye Name: 5-methyl-1,10-dioxo-4,7-dihydro-4,7-phenanthroline-3,8-dicarboxylic acid CAS Name: 5-methyl-1,10-dioxo-4,7-dihydro-4,7-phenanthroline-3,8-dicarboxylic acid IUPAC Name: 5-methyl-1,10-dioxo-4,7-dihydro-4,7-phenanthroline-3,8-dicarboxylic acid Traditional Name: 1,10-diketo-5-methyl-4,7-dihydro-4,7-phenanthroline-3,8-dicarboxylic acid Formula: C15H10N2O6 MolecularWeight: 314.2497

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=O)C=C(N2)C(=O)O)C3=C1NC(=CC3=O)C(=O)O

Isomeric SMILES

CC1=CC2=C(C(=O)C=C(N2)C(=O)O)C3=C1NC(=CC3=O)C(=O)O

InChI

InChI=1S/C15H10N2O6/c1-5-2-6-11(9(18)3-7(16-6)14(20)21)12-10(19)4-8(15(22)23)17-13(5)12/h2-4H,1H3,(H,16,18)(H,17,19)(H,20,21)(H,22,23)