4-[3-(benzimidazol-1-ylmethyl)phenyl]-2,4-bis(oxidanylidene)butanoic acid

Systemtic Name: 4-[3-(benzimidazol-1-ylmethyl)phenyl]-2,4-bis(oxidanylidene)butanoic acid Openeye Name: 4-[3-(benzimidazol-1-ylmethyl)phenyl]-2,4-dioxo-butanoic acid CAS Name: 4-[3-(1-benzimidazolylmethyl)phenyl]-2,4-dioxobutanoic acid IUPAC Name: 4-[3-(benzimidazol-1-ylmethyl)phenyl]-2,4-dioxobutanoic acid Traditional Name: 4-[3-(benzimidazol-1-ylmethyl)phenyl]-2,4-diketo-butyric acid Formula: C18H14N2O4 MolecularWeight: 322.31476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CC3=CC=CC(=C3)C(=O)CC(=O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CC3=CC=CC(=C3)C(=O)CC(=O)C(=O)O

InChI

InChI=1S/C18H14N2O4/c21-16(9-17(22)18(23)24)13-5-3-4-12(8-13)10-20-11-19-14-6-1-2-7-15(14)20/h1-8,11H,9-10H2,(H,23,24)