3-[[3-methoxy-5-(quinolin-2-ylmethoxy)phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[3-methoxy-5-(quinolin-2-ylmethoxy)phenoxy]methyl]benzoic acid Openeye Name: 3-[[3-methoxy-5-(2-quinolylmethoxy)phenoxy]methyl]benzoic acid CAS Name: 3-[[3-methoxy-5-(2-quinolinylmethoxy)phenoxy]methyl]benzoic acid IUPAC Name: 3-[[3-methoxy-5-(quinolin-2-ylmethoxy)phenoxy]methyl]benzoic acid Traditional Name: 3-[[3-methoxy-5-(2-quinolylmethoxy)phenoxy]methyl]benzoic acid Formula: C25H21NO5 MolecularWeight: 415.43794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)OCC2=NC3=CC=CC=C3C=C2)OCC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1)OCC2=NC3=CC=CC=C3C=C2)OCC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C25H21NO5/c1-29-21-12-22(30-15-17-5-4-7-19(11-17)25(27)28)14-23(13-21)31-16-20-10-9-18-6-2-3-8-24(18)26-20/h2-14H,15-16H2,1H3,(H,27,28)