(3-methylphenyl) adamantane-1-carboxylate

Systemtic Name: (3-methylphenyl) adamantane-1-carboxylate Openeye Name: m-tolyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid m-tolyl ester Formula: C18H22O2 MolecularWeight: 270.36608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H22O2/c1-12-3-2-4-16(5-12)20-17(19)18-9-13-6-14(10-18)8-15(7-13)11-18/h2-5,13-15H,6-11H2,1H3