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

Systemtic Name: 2-methyl-3-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]benzoic acid Openeye Name: 2-methyl-3-[[3-(2-quinolylmethoxy)phenoxy]methyl]benzoic acid CAS Name: 2-methyl-3-[[3-(2-quinolinylmethoxy)phenoxy]methyl]benzoic acid IUPAC Name: 2-methyl-3-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]benzoic acid Traditional Name: 2-methyl-3-[[3-(2-quinolylmethoxy)phenoxy]methyl]benzoic acid Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)O

InChI

InChI=1S/C25H21NO4/c1-17-19(7-4-10-23(17)25(27)28)15-29-21-8-5-9-22(14-21)30-16-20-13-12-18-6-2-3-11-24(18)26-20/h2-14H,15-16H2,1H3,(H,27,28)