ethyl 3-methylsulfonyloxy-1-[(phenylmethyl)amino]bicyclo[2.2.2]octane-4-carboxylate

Systemtic Name: ethyl 3-methylsulfonyloxy-1-[(phenylmethyl)amino]bicyclo[2.2.2]octane-4-carboxylate Openeye Name: ethyl 1-(benzylamino)-3-methylsulfonyloxy-bicyclo[2.2.2]octane-4-carboxylate CAS Name: 3-methylsulfonyloxy-1-[(phenylmethyl)amino]-4-bicyclo[2.2.2]octanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzylamino)-3-methylsulfonyloxybicyclo[2.2.2]octane-4-carboxylate Traditional Name: 1-(benzylamino)-3-methylsulfonyloxy-bicyclo[2.2.2]octane-4-carboxylic acid ethyl ester Formula: C19H27NO5S MolecularWeight: 381.48638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12CCC(CC1)(CC2OS(=O)(=O)C)NCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C12CCC(CC1)(CC2OS(=O)(=O)C)NCC3=CC=CC=C3

InChI

InChI=1S/C19H27NO5S/c1-3-24-17(21)19-11-9-18(10-12-19,13-16(19)25-26(2,22)23)20-14-15-7-5-4-6-8-15/h4-8,16,20H,3,9-14H2,1-2H3