(4-propan-2-ylphenyl)methyl 3-oxidanyladamantane-1-carboxylate

Systemtic Name: (4-propan-2-ylphenyl)methyl 3-oxidanyladamantane-1-carboxylate Openeye Name: (4-isopropylphenyl)methyl 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid (4-isopropylbenzyl) ester Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC(=O)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC(=O)C23CC4CC(C2)CC(C4)(C3)O

InChI

InChI=1S/C21H28O3/c1-14(2)18-5-3-15(4-6-18)12-24-19(22)20-8-16-7-17(9-20)11-21(23,10-16)13-20/h3-6,14,16-17,23H,7-13H2,1-2H3