(phenylmethyl) 4-[2-[3-(1-adamantyl)-4-methoxy-phenyl]-2-oxidanylidene-ethoxy]-2-oxidanyl-benzoate

Systemtic Name: (phenylmethyl) 4-[2-[3-(1-adamantyl)-4-methoxy-phenyl]-2-oxidanylidene-ethoxy]-2-oxidanyl-benzoate Openeye Name: benzyl 4-[2-[3-(1-adamantyl)-4-methoxy-phenyl]-2-oxo-ethoxy]-2-hydroxy-benzoate CAS Name: 4-[2-[3-(1-adamantyl)-4-methoxyphenyl]-2-oxoethoxy]-2-hydroxybenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-[3-(1-adamantyl)-4-methoxyphenyl]-2-oxoethoxy]-2-hydroxybenzoate Traditional Name: 4-[2-[3-(1-adamantyl)-4-methoxy-phenyl]-2-keto-ethoxy]-2-hydroxy-benzoic acid benzyl ester Formula: C33H34O6 MolecularWeight: 526.61946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC2=CC(=C(C=C2)C(=O)OCC3=CC=CC=C3)O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC2=CC(=C(C=C2)C(=O)OCC3=CC=CC=C3)O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C33H34O6/c1-37-31-10-7-25(14-28(31)33-16-22-11-23(17-33)13-24(12-22)18-33)30(35)20-38-26-8-9-27(29(34)15-26)32(36)39-19-21-5-3-2-4-6-21/h2-10,14-15,22-24,34H,11-13,16-20H2,1H3