5-[5-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)iminomethyl]furan-2-yl]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[5-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)iminomethyl]furan-2-yl]benzene-1,3-dicarboxylic acid Openeye Name: 5-[5-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)iminomethyl]-2-furyl]benzene-1,3-dicarboxylic acid CAS Name: 5-[5-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)iminomethyl]-2-furanyl]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[5-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)iminomethyl]furan-2-yl]benzene-1,3-dicarboxylic acid Traditional Name: 5-[5-[(2-keto-1,3-dihydrobenzimidazol-5-yl)iminomethyl]-2-furyl]isophthalic acid Formula: C20H13N3O6 MolecularWeight: 391.33372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N=CC3=CC=C(O3)C4=CC(=CC(=C4)C(=O)O)C(=O)O)NC(=O)N2

Isomeric SMILES

C1=CC2=C(C=C1N=CC3=CC=C(O3)C4=CC(=CC(=C4)C(=O)O)C(=O)O)NC(=O)N2

InChI

InChI=1S/C20H13N3O6/c24-18(25)11-5-10(6-12(7-11)19(26)27)17-4-2-14(29-17)9-21-13-1-3-15-16(8-13)23-20(28)22-15/h1-9H,(H,24,25)(H,26,27)(H2,22,23,28)