(2-ethoxyphenyl)methyl (5S,7R)-3-oxidanyladamantane-1-carboxylate

Systemtic Name: (2-ethoxyphenyl)methyl (5S,7R)-3-oxidanyladamantane-1-carboxylate Openeye Name: (2-ethoxyphenyl)methyl (5S,7R)-3-hydroxyadamantane-1-carboxylate CAS Name: (5S,7R)-3-hydroxy-1-adamantanecarboxylic acid (2-ethoxyphenyl)methyl ester IUPAC Name: (2-ethoxyphenyl)methyl (5S,7R)-3-hydroxyadamantane-1-carboxylate Traditional Name: (5S,7R)-3-hydroxyadamantane-1-carboxylic acid (2-ethoxybenzyl) ester Formula: C20H26O4 MolecularWeight: 330.41804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1COC(=O)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CCOC1=CC=CC=C1COC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)O

InChI

InChI=1S/C20H26O4/c1-2-23-17-6-4-3-5-16(17)12-24-18(21)19-8-14-7-15(9-19)11-20(22,10-14)13-19/h3-6,14-15,22H,2,7-13H2,1H3/t14-,15+,19?,20?