methyl 4-[7-(1-adamantyl)-6-phenylmethoxy-naphthalen-2-yl]-2-oxidanyl-benzoate

Systemtic Name: methyl 4-[7-(1-adamantyl)-6-phenylmethoxy-naphthalen-2-yl]-2-oxidanyl-benzoate Openeye Name: methyl 4-[7-(1-adamantyl)-6-benzyloxy-2-naphthyl]-2-hydroxy-benzoate CAS Name: 4-[7-(1-adamantyl)-6-phenylmethoxy-2-naphthalenyl]-2-hydroxybenzoic acid methyl ester IUPAC Name: methyl 4-[7-(1-adamantyl)-6-phenylmethoxynaphthalen-2-yl]-2-hydroxybenzoate Traditional Name: 4-[7-(1-adamantyl)-6-benzoxy-2-naphthyl]-2-hydroxy-benzoic acid methyl ester Formula: C35H34O4 MolecularWeight: 518.64206

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)C2=CC3=CC(=C(C=C3C=C2)OCC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6)O

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)C2=CC3=CC(=C(C=C3C=C2)OCC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6)O

InChI

InChI=1S/C35H34O4/c1-38-34(37)30-10-9-27(16-32(30)36)26-7-8-28-17-33(39-21-22-5-3-2-4-6-22)31(15-29(28)14-26)35-18-23-11-24(19-35)13-25(12-23)20-35/h2-10,14-17,23-25,36H,11-13,18-21H2,1H3