4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)ethyl]naphthalen-2-yl]benzoic acid

Systemtic Name: 4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)ethyl]naphthalen-2-yl]benzoic acid Openeye Name: 4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)ethyl]-2-naphthyl]benzoic acid CAS Name: 4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)ethyl]-2-naphthalenyl]benzoic acid IUPAC Name: 4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)ethyl]naphthalen-2-yl]benzoic acid Traditional Name: 4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)ethyl]-2-naphthyl]benzoic acid Formula: C31H34O4 MolecularWeight: 470.59926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C2C=C(C=CC2=C1)C3=CC=C(C=C3)C(=O)O)C45CC6CC(C4)CC(C6)C5)OCOC

Isomeric SMILES

CC(C1=C(C=C2C=C(C=CC2=C1)C3=CC=C(C=C3)C(=O)O)C45CC6CC(C4)CC(C6)C5)OCOC

InChI

InChI=1S/C31H34O4/c1-19(35-18-34-2)28-13-26-8-7-25(23-3-5-24(6-4-23)30(32)33)12-27(26)14-29(28)31-15-20-9-21(16-31)11-22(10-20)17-31/h3-8,12-14,19-22H,9-11,15-18H2,1-2H3,(H,32,33)