4-oxidanylidene-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]-1H-quinoline-2-carboxylic acid

Systemtic Name: 4-oxidanylidene-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]-1H-quinoline-2-carboxylic acid Openeye Name: 4-oxo-7-[[3-(2-quinolylmethoxy)phenyl]methoxy]-1H-quinoline-2-carboxylic acid CAS Name: 4-oxo-7-[[3-(2-quinolinylmethoxy)phenyl]methoxy]-1H-quinoline-2-carboxylic acid IUPAC Name: 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]-1H-quinoline-2-carboxylic acid Traditional Name: 4-keto-7-[3-(2-quinolylmethoxy)benzyl]oxy-1H-quinoline-2-carboxylic acid Formula: C27H20N2O5 MolecularWeight: 452.4581

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=CC(=C3)COC4=CC5=C(C=C4)C(=O)C=C(N5)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=CC(=C3)COC4=CC5=C(C=C4)C(=O)C=C(N5)C(=O)O

InChI

InChI=1S/C27H20N2O5/c30-26-14-25(27(31)32)29-24-13-21(10-11-22(24)26)33-15-17-4-3-6-20(12-17)34-16-19-9-8-18-5-1-2-7-23(18)28-19/h1-14H,15-16H2,(H,29,30)(H,31,32)