(2S,3R)-2-(thiophen-2-ylmethylcarbamoyl)bicyclo[2.2.2]octane-3-carboxylate

Systemtic Name: (2S,3R)-2-(thiophen-2-ylmethylcarbamoyl)bicyclo[2.2.2]octane-3-carboxylate Openeye Name: (2S,3R)-2-(2-thienylmethylcarbamoyl)bicyclo[2.2.2]octane-3-carboxylate CAS Name: (2S,3R)-2-[oxo-(thiophen-2-ylmethylamino)methyl]-3-bicyclo[2.2.2]octanecarboxylate IUPAC Name: (2S,3R)-2-(thiophen-2-ylmethylcarbamoyl)bicyclo[2.2.2]octane-3-carboxylate Traditional Name: (2S,3R)-2-(2-thenylcarbamoyl)bicyclo[2.2.2]octane-3-carboxylate Formula: C15H18NO3S- MolecularWeight: 292.37332

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CCC1C(C2C(=O)[O-])C(=O)NCC3=CC=CS3

Isomeric SMILES

C1CC2CCC1[C@@H]([C@@H]2C(=O)[O-])C(=O)NCC3=CC=CS3

InChI

InChI=1S/C15H19NO3S/c17-14(16-8-11-2-1-7-20-11)12-9-3-5-10(6-4-9)13(12)15(18)19/h1-2,7,9-10,12-13H,3-6,8H2,(H,16,17)(H,18,19)/p-1/t9?,10?,12-,13+/m0/s1