(2S,3S)-2-(phenylcarbamoyl)bicyclo[2.2.2]octane-3-carboxylate

Systemtic Name: (2S,3S)-2-(phenylcarbamoyl)bicyclo[2.2.2]octane-3-carboxylate Openeye Name: (2S,3S)-2-(phenylcarbamoyl)bicyclo[2.2.2]octane-3-carboxylate CAS Name: (2S,3S)-2-[anilino(oxo)methyl]-3-bicyclo[2.2.2]octanecarboxylate IUPAC Name: (2S,3S)-2-(phenylcarbamoyl)bicyclo[2.2.2]octane-3-carboxylate Traditional Name: (2S,3S)-2-(phenylcarbamoyl)bicyclo[2.2.2]octane-3-carboxylate Formula: C16H18NO3- MolecularWeight: 272.31902

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CCC1C(C2C(=O)[O-])C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CC2CCC1[C@@H]([C@H]2C(=O)[O-])C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C16H19NO3/c18-15(17-12-4-2-1-3-5-12)13-10-6-8-11(9-7-10)14(13)16(19)20/h1-5,10-11,13-14H,6-9H2,(H,17,18)(H,19,20)/p-1/t10?,11?,13-,14-/m0/s1