2-methyl-6-[[3-(pyridin-2-ylmethoxymethyl)phenoxy]methyl]benzoic acid

Systemtic Name: 2-methyl-6-[[3-(pyridin-2-ylmethoxymethyl)phenoxy]methyl]benzoic acid Openeye Name: 2-methyl-6-[[3-(2-pyridylmethoxymethyl)phenoxy]methyl]benzoic acid CAS Name: 2-methyl-6-[[3-(2-pyridinylmethoxymethyl)phenoxy]methyl]benzoic acid IUPAC Name: 2-methyl-6-[[3-(pyridin-2-ylmethoxymethyl)phenoxy]methyl]benzoic acid Traditional Name: 2-methyl-6-[[3-(2-pyridylmethoxymethyl)phenoxy]methyl]benzoic acid Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC=CC(=C2)COCC3=CC=CC=N3)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC=CC(=C2)COCC3=CC=CC=N3)C(=O)O

InChI

InChI=1S/C22H21NO4/c1-16-6-4-8-18(21(16)22(24)25)14-27-20-10-5-7-17(12-20)13-26-15-19-9-2-3-11-23-19/h2-12H,13-15H2,1H3,(H,24,25)