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

Systemtic Name: 4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)propyl]naphthalen-2-yl]benzoic acid Openeye Name: 4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)propyl]-2-naphthyl]benzoic acid CAS Name: 4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)propyl]-2-naphthalenyl]benzoic acid IUPAC Name: 4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)propyl]naphthalen-2-yl]benzoic acid Traditional Name: 4-[7-(1-adamantyl)-6-[1-(methoxymethoxy)propyl]-2-naphthyl]benzoic acid Formula: C32H36O4 MolecularWeight: 484.62584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(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/C32H36O4/c1-3-30(36-19-35-2)28-14-26-9-8-25(23-4-6-24(7-5-23)31(33)34)13-27(26)15-29(28)32-16-20-10-21(17-32)12-22(11-20)18-32/h4-9,13-15,20-22,30H,3,10-12,16-19H2,1-2H3,(H,33,34)