3-[[4-(1-adamantyl)-3-methoxy-phenyl]methoxy]-2-phenyl-benzoic acid

Systemtic Name: 3-[[4-(1-adamantyl)-3-methoxy-phenyl]methoxy]-2-phenyl-benzoic acid Openeye Name: 3-[[4-(1-adamantyl)-3-methoxy-phenyl]methoxy]-2-phenyl-benzoic acid CAS Name: 3-[[4-(1-adamantyl)-3-methoxyphenyl]methoxy]-2-phenylbenzoic acid IUPAC Name: 3-[[4-(1-adamantyl)-3-methoxyphenyl]methoxy]-2-phenylbenzoic acid Traditional Name: 3-[4-(1-adamantyl)-3-methoxy-benzyl]oxy-2-phenyl-benzoic acid Formula: C31H32O4 MolecularWeight: 468.58338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)COC2=CC=CC(=C2C3=CC=CC=C3)C(=O)O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=C(C=CC(=C1)COC2=CC=CC(=C2C3=CC=CC=C3)C(=O)O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H32O4/c1-34-28-15-20(10-11-26(28)31-16-21-12-22(17-31)14-23(13-21)18-31)19-35-27-9-5-8-25(30(32)33)29(27)24-6-3-2-4-7-24/h2-11,15,21-23H,12-14,16-19H2,1H3,(H,32,33)