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

Systemtic Name: methyl (1S,3S,4R)-3-thiophen-2-yl-7-azabicyclo[2.2.1]heptane-7-carboxylate Openeye Name: methyl (1S,3S,4R)-3-(2-thienyl)-7-azabicyclo[2.2.1]heptane-7-carboxylate CAS Name: (1S,3S,4R)-3-thiophen-2-yl-7-azabicyclo[2.2.1]heptane-7-carboxylic acid methyl ester IUPAC Name: methyl (1S,3S,4R)-3-thiophen-2-yl-7-azabicyclo[2.2.1]heptane-7-carboxylate Traditional Name: (1S,3S,4R)-3-(2-thienyl)-7-azabicyclo[2.2.1]heptane-7-carboxylic acid methyl ester Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C2CCC1C(C2)C3=CC=CS3

Isomeric SMILES

COC(=O)N1[C@H]2CC[C@@H]1[C@H](C2)C3=CC=CS3

InChI

InChI=1S/C12H15NO2S/c1-15-12(14)13-8-4-5-10(13)9(7-8)11-3-2-6-16-11/h2-3,6,8-10H,4-5,7H2,1H3/t8-,9-,10+/m0/s1