3-(hydroxymethyl)-7-[[4-methoxy-3-(4-oxidanyloxan-2-yl)phenyl]methoxy]-4-phenyl-naphthalene-2-carboxylic acid

Systemtic Name: 3-(hydroxymethyl)-7-[[4-methoxy-3-(4-oxidanyloxan-2-yl)phenyl]methoxy]-4-phenyl-naphthalene-2-carboxylic acid Openeye Name: 3-(hydroxymethyl)-7-[[3-(4-hydroxytetrahydropyran-2-yl)-4-methoxy-phenyl]methoxy]-4-phenyl-naphthalene-2-carboxylic acid CAS Name: 3-(hydroxymethyl)-7-[[3-(4-hydroxy-2-oxanyl)-4-methoxyphenyl]methoxy]-4-phenyl-2-naphthalenecarboxylic acid IUPAC Name: 3-(hydroxymethyl)-7-[[3-(4-hydroxyoxan-2-yl)-4-methoxyphenyl]methoxy]-4-phenylnaphthalene-2-carboxylic acid Traditional Name: 7-[3-(4-hydroxytetrahydropyran-2-yl)-4-methoxy-benzyl]oxy-3-methylol-4-phenyl-2-naphthoic acid Formula: C31H30O7 MolecularWeight: 514.5657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC2=CC3=CC(=C(C(=C3C=C2)C4=CC=CC=C4)CO)C(=O)O)C5CC(CCO5)O

Isomeric SMILES

COC1=C(C=C(C=C1)COC2=CC3=CC(=C(C(=C3C=C2)C4=CC=CC=C4)CO)C(=O)O)C5CC(CCO5)O

InChI

InChI=1S/C31H30O7/c1-36-28-10-7-19(13-26(28)29-16-22(33)11-12-37-29)18-38-23-8-9-24-21(14-23)15-25(31(34)35)27(17-32)30(24)20-5-3-2-4-6-20/h2-10,13-15,22,29,32-33H,11-12,16-18H2,1H3,(H,34,35)