ethyl (2S,3S)-2-(4-methylphenyl)bicyclo[2.2.2]octane-3-carboxylate

Systemtic Name: ethyl (2S,3S)-2-(4-methylphenyl)bicyclo[2.2.2]octane-3-carboxylate Openeye Name: ethyl (2S,3S)-2-(p-tolyl)bicyclo[2.2.2]octane-3-carboxylate CAS Name: (2S,3S)-2-(4-methylphenyl)-3-bicyclo[2.2.2]octanecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3S)-2-(4-methylphenyl)bicyclo[2.2.2]octane-3-carboxylate Traditional Name: (2S,3S)-2-(p-tolyl)bicyclo[2.2.2]octane-3-carboxylic acid ethyl ester Formula: C18H24O2 MolecularWeight: 272.38196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2CCC(C1C3=CC=C(C=C3)C)CC2

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](C2CCC1CC2)C3=CC=C(C=C3)C

InChI

InChI=1S/C18H24O2/c1-3-20-18(19)17-15-10-8-14(9-11-15)16(17)13-6-4-12(2)5-7-13/h4-7,14-17H,3,8-11H2,1-2H3/t14?,15?,16-,17-/m0/s1