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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC3=C(C=C2)C=C(C=C3)C(=O)OC)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC3=C(C=C2)C=C(C=C3)C(=O)OC)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C29H30O3/c1-31-27-8-7-24(14-26(27)29-15-18-9-19(16-29)11-20(10-18)17-29)22-3-4-23-13-25(28(30)32-2)6-5-21(23)12-22/h3-8,12-14,18-20H,9-11,15-17H2,1-2H3