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

Systemtic Name: methyl (1R,3R,4S,5S)-8-methyl-3-phenacyl-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: methyl (1R,3R,4S,5S)-8-methyl-3-phenacyl-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: (1R,3R,4S,5S)-8-methyl-3-phenacyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester IUPAC Name: methyl (1R,3R,4S,5S)-8-methyl-3-phenacyl-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: (1R,3R,4S,5S)-8-methyl-3-phenacyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO3/c1-19-14-8-9-15(19)17(18(21)22-2)13(10-14)11-16(20)12-6-4-3-5-7-12/h3-7,13-15,17H,8-11H2,1-2H3/t13-,14-,15+,17+/m1/s1