methyl 6-[3-(1-adamantyl)-4-(hydroxymethyl)phenyl]naphthalene-2-carboxylate

Systemtic Name: methyl 6-[3-(1-adamantyl)-4-(hydroxymethyl)phenyl]naphthalene-2-carboxylate Openeye Name: methyl 6-[3-(1-adamantyl)-4-(hydroxymethyl)phenyl]naphthalene-2-carboxylate CAS Name: 6-[3-(1-adamantyl)-4-(hydroxymethyl)phenyl]-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 6-[3-(1-adamantyl)-4-(hydroxymethyl)phenyl]naphthalene-2-carboxylate Traditional Name: 6-[3-(1-adamantyl)-4-methylol-phenyl]naphthalene-2-carboxylic acid methyl ester Formula: C29H30O3 MolecularWeight: 426.5467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C=C(C=C2)C3=CC(=C(C=C3)CO)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C=C(C=C2)C3=CC(=C(C=C3)CO)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C29H30O3/c1-32-28(31)25-6-4-21-11-22(2-3-23(21)12-25)24-5-7-26(17-30)27(13-24)29-14-18-8-19(15-29)10-20(9-18)16-29/h2-7,11-13,18-20,30H,8-10,14-17H2,1H3