4-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)naphthalen-2-yl]benzoic acid

Systemtic Name: 4-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)naphthalen-2-yl]benzoic acid Openeye Name: 4-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)-2-naphthyl]benzoic acid CAS Name: 4-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)-2-naphthalenyl]benzoic acid IUPAC Name: 4-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)naphthalen-2-yl]benzoic acid Traditional Name: 4-[7-(2-adamantyl)-6-(2-methoxyethoxymethoxy)-2-naphthyl]benzoic acid Formula: C31H34O5 MolecularWeight: 486.59866

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCOC1=C(C=C2C=C(C=CC2=C1)C3=CC=C(C=C3)C(=O)O)C4C5CC6CC(C5)CC4C6

Isomeric SMILES

COCCOCOC1=C(C=C2C=C(C=CC2=C1)C3=CC=C(C=C3)C(=O)O)C4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C31H34O5/c1-34-8-9-35-18-36-29-17-24-7-6-23(21-2-4-22(5-3-21)31(32)33)15-25(24)16-28(29)30-26-11-19-10-20(13-26)14-27(30)12-19/h2-7,15-17,19-20,26-27,30H,8-14,18H2,1H3,(H,32,33)