(4,5-dimethoxy-2-methyl-phenyl)methyl adamantane-1-carboxylate

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl adamantane-1-carboxylate Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (4,5-dimethoxy-2-methylphenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (4,5-dimethoxy-2-methyl-benzyl) ester Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1COC(=O)C23CC4CC(C2)CC(C4)C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1COC(=O)C23CC4CC(C2)CC(C4)C3)OC)OC

InChI

InChI=1S/C21H28O4/c1-13-4-18(23-2)19(24-3)8-17(13)12-25-20(22)21-9-14-5-15(10-21)7-16(6-14)11-21/h4,8,14-16H,5-7,9-12H2,1-3H3