[4-(hydroxymethyl)phenyl] 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoate

Systemtic Name: [4-(hydroxymethyl)phenyl] 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoate Openeye Name: [4-(hydroxymethyl)phenyl] 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoate CAS Name: 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoic acid [4-(hydroxymethyl)phenyl] ester IUPAC Name: [4-(hydroxymethyl)phenyl] 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoate Traditional Name: 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoic acid (4-methylolphenyl) ester Formula: C28H34O6 MolecularWeight: 466.56596

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC)OCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)CO)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(OC)OCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)CO)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H34O6/c1-18(31-2)32-17-33-26-8-5-23(27(30)34-24-6-3-19(16-29)4-7-24)12-25(26)28-13-20-9-21(14-28)11-22(10-20)15-28/h3-8,12,18,20-22,29H,9-11,13-17H2,1-2H3