phenethyl (1R,3S,4S,5S)-8-methyl-3-oxidanyl-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: phenethyl (1R,3S,4S,5S)-8-methyl-3-oxidanyl-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: phenethyl (1R,3S,4S,5S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: (1R,3S,4S,5S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid phenethyl ester IUPAC Name: phenethyl (1R,3S,4S,5S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: (1R,3S,4S,5S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid phenethyl ester Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1C(C(C2)O)C(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CN1[C@@H]2CC[C@H]1[C@@H]([C@H](C2)O)C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)16(15(19)11-13)17(20)21-10-9-12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16+/m1/s1