(phenylmethyl) 6-[3-(1-adamantyl)-4-oxidanyl-phenyl]naphthalene-2-carboxylate

Systemtic Name: (phenylmethyl) 6-[3-(1-adamantyl)-4-oxidanyl-phenyl]naphthalene-2-carboxylate Openeye Name: benzyl 6-[3-(1-adamantyl)-4-hydroxy-phenyl]naphthalene-2-carboxylate CAS Name: 6-[3-(1-adamantyl)-4-hydroxyphenyl]-2-naphthalenecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[3-(1-adamantyl)-4-hydroxyphenyl]naphthalene-2-carboxylate Traditional Name: 6-[3-(1-adamantyl)-4-hydroxy-phenyl]naphthalene-2-carboxylic acid benzyl ester Formula: C34H32O3 MolecularWeight: 488.61608

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=C(C=CC(=C4)C5=CC6=C(C=C5)C=C(C=C6)C(=O)OCC7=CC=CC=C7)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=C(C=CC(=C4)C5=CC6=C(C=C5)C=C(C=C6)C(=O)OCC7=CC=CC=C7)O

InChI

InChI=1S/C34H32O3/c35-32-11-10-29(17-31(32)34-18-23-12-24(19-34)14-25(13-23)20-34)27-6-7-28-16-30(9-8-26(28)15-27)33(36)37-21-22-4-2-1-3-5-22/h1-11,15-17,23-25,35H,12-14,18-21H2