(4-methylphenyl)methyl (5S,7R)-3-oxidanyladamantane-1-carboxylate

Systemtic Name: (4-methylphenyl)methyl (5S,7R)-3-oxidanyladamantane-1-carboxylate Openeye Name: p-tolylmethyl (5S,7R)-3-hydroxyadamantane-1-carboxylate CAS Name: (5S,7R)-3-hydroxy-1-adamantanecarboxylic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl (5S,7R)-3-hydroxyadamantane-1-carboxylate Traditional Name: (5S,7R)-3-hydroxyadamantane-1-carboxylic acid (4-methylbenzyl) ester Formula: C19H24O3 MolecularWeight: 300.39206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)O

InChI

InChI=1S/C19H24O3/c1-13-2-4-14(5-3-13)11-22-17(20)18-7-15-6-16(8-18)10-19(21,9-15)12-18/h2-5,15-16,21H,6-12H2,1H3/t15-,16+,18?,19?