ethyl (1R,4S)-3-(phenylsulfonyl)-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylate

Systemtic Name: ethyl (1R,4S)-3-(phenylsulfonyl)-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylate Openeye Name: ethyl (1R,4S)-3-(benzenesulfonyl)-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylate CAS Name: (1R,4S)-3-(benzenesulfonyl)-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,4S)-3-(benzenesulfonyl)-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylate Traditional Name: (1R,4S)-3-besyl-3-azabicyclo[2.2.1]hept-5-ene-2-carboxylic acid ethyl ester Formula: C15H17NO4S MolecularWeight: 307.36478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2CC(N1S(=O)(=O)C3=CC=CC=C3)C=C2

Isomeric SMILES

CCOC(=O)C1[C@@H]2C[C@H](N1S(=O)(=O)C3=CC=CC=C3)C=C2

InChI

InChI=1S/C15H17NO4S/c1-2-20-15(17)14-11-8-9-12(10-11)16(14)21(18,19)13-6-4-3-5-7-13/h3-9,11-12,14H,2,10H2,1H3/t11-,12+,14?/m0/s1