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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1COCCC1C(C2=CC3=CC(=C(C(=C3C=C2)C4=CC=CC=C4)CO)C(=O)O)OC5=CC=CC=C5

Isomeric SMILES

COC1COCCC1C(C2=CC3=CC(=C(C(=C3C=C2)C4=CC=CC=C4)CO)C(=O)O)OC5=CC=CC=C5

InChI

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