ethyl (2S,4R)-4-(3-chlorophenyl)-1-(phenylsulfonyl)azetidine-2-carboxylate

Systemtic Name: ethyl (2S,4R)-4-(3-chlorophenyl)-1-(phenylsulfonyl)azetidine-2-carboxylate Openeye Name: ethyl (2S,4R)-1-(benzenesulfonyl)-4-(3-chlorophenyl)azetidine-2-carboxylate CAS Name: (2S,4R)-1-(benzenesulfonyl)-4-(3-chlorophenyl)-2-azetidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,4R)-1-(benzenesulfonyl)-4-(3-chlorophenyl)azetidine-2-carboxylate Traditional Name: (2S,4R)-1-besyl-4-(3-chlorophenyl)azetidine-2-carboxylic acid ethyl ester Formula: C18H18ClNO4S MolecularWeight: 379.85782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(N1S(=O)(=O)C2=CC=CC=C2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)[C@@H]1C[C@@H](N1S(=O)(=O)C2=CC=CC=C2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H18ClNO4S/c1-2-24-18(21)17-12-16(13-7-6-8-14(19)11-13)20(17)25(22,23)15-9-4-3-5-10-15/h3-11,16-17H,2,12H2,1H3/t16-,17+/m1/s1