methyl (1S,2S,3S,4R)-7-methyl-2-phenethyl-7-azabicyclo[2.2.1]heptane-3-carboxylate

Systemtic Name: methyl (1S,2S,3S,4R)-7-methyl-2-phenethyl-7-azabicyclo[2.2.1]heptane-3-carboxylate Openeye Name: methyl (1S,2S,3S,4R)-7-methyl-2-phenethyl-7-azabicyclo[2.2.1]heptane-3-carboxylate CAS Name: (1S,2S,3S,4R)-7-methyl-2-phenethyl-7-azabicyclo[2.2.1]heptane-3-carboxylic acid methyl ester IUPAC Name: methyl (1S,2S,3S,4R)-7-methyl-2-phenethyl-7-azabicyclo[2.2.1]heptane-3-carboxylate Traditional Name: (1S,2S,3S,4R)-7-methyl-2-phenethyl-7-azabicyclo[2.2.1]heptane-3-carboxylic acid methyl ester Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1C(C2CCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CN1[C@H]2CC[C@@H]1[C@H]([C@@H]2CCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C17H23NO2/c1-18-14-10-11-15(18)16(17(19)20-2)13(14)9-8-12-6-4-3-5-7-12/h3-7,13-16H,8-11H2,1-2H3/t13-,14+,15-,16+/m1/s1