2-[[2-oxidanylidene-6-(quinolin-2-ylmethoxy)quinolin-1-yl]methyl]benzoic acid

Systemtic Name: 2-[[2-oxidanylidene-6-(quinolin-2-ylmethoxy)quinolin-1-yl]methyl]benzoic acid Openeye Name: 2-[[2-oxo-6-(2-quinolylmethoxy)-1-quinolyl]methyl]benzoic acid CAS Name: 2-[[2-oxo-6-(2-quinolinylmethoxy)-1-quinolinyl]methyl]benzoic acid IUPAC Name: 2-[[2-oxo-6-(quinolin-2-ylmethoxy)quinolin-1-yl]methyl]benzoic acid Traditional Name: 2-[[2-keto-6-(2-quinolylmethoxy)-1-quinolyl]methyl]benzoic acid Formula: C27H20N2O4 MolecularWeight: 436.4587

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC4=C(C=C3)N(C(=O)C=C4)CC5=CC=CC=C5C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC4=C(C=C3)N(C(=O)C=C4)CC5=CC=CC=C5C(=O)O

InChI

InChI=1S/C27H20N2O4/c30-26-14-10-19-15-22(33-17-21-11-9-18-5-2-4-8-24(18)28-21)12-13-25(19)29(26)16-20-6-1-3-7-23(20)27(31)32/h1-15H,16-17H2,(H,31,32)