3-(hydroxymethyl)-7-[[3-(4-methoxyoxan-2-yl)phenoxy]methyl]-4-phenyl-naphthalene-2-carboxylic acid

Systemtic Name: 3-(hydroxymethyl)-7-[[3-(4-methoxyoxan-2-yl)phenoxy]methyl]-4-phenyl-naphthalene-2-carboxylic acid Openeye Name: 3-(hydroxymethyl)-7-[[3-(4-methoxytetrahydropyran-2-yl)phenoxy]methyl]-4-phenyl-naphthalene-2-carboxylic acid CAS Name: 3-(hydroxymethyl)-7-[[3-(4-methoxy-2-oxanyl)phenoxy]methyl]-4-phenyl-2-naphthalenecarboxylic acid IUPAC Name: 3-(hydroxymethyl)-7-[[3-(4-methoxyoxan-2-yl)phenoxy]methyl]-4-phenylnaphthalene-2-carboxylic acid Traditional Name: 7-[[3-(4-methoxytetrahydropyran-2-yl)phenoxy]methyl]-3-methylol-4-phenyl-2-naphthoic acid Formula: C31H30O6 MolecularWeight: 498.5663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CCOC(C1)C2=CC(=CC=C2)OCC3=CC4=CC(=C(C(=C4C=C3)C5=CC=CC=C5)CO)C(=O)O

Isomeric SMILES

COC1CCOC(C1)C2=CC(=CC=C2)OCC3=CC4=CC(=C(C(=C4C=C3)C5=CC=CC=C5)CO)C(=O)O

InChI

InChI=1S/C31H30O6/c1-35-24-12-13-36-29(17-24)22-8-5-9-25(15-22)37-19-20-10-11-26-23(14-20)16-27(31(33)34)28(18-32)30(26)21-6-3-2-4-7-21/h2-11,14-16,24,29,32H,12-13,17-19H2,1H3,(H,33,34)