ethyl (2S,3S,4R)-4-methyl-1-(4-methylphenyl)sulfonyl-3-phenyl-azetidine-2-carboxylate

Systemtic Name: ethyl (2S,3S,4R)-4-methyl-1-(4-methylphenyl)sulfonyl-3-phenyl-azetidine-2-carboxylate Openeye Name: ethyl (2S,3S,4R)-4-methyl-3-phenyl-1-(p-tolylsulfonyl)azetidine-2-carboxylate CAS Name: (2S,3S,4R)-4-methyl-1-(4-methylphenyl)sulfonyl-3-phenyl-2-azetidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3S,4R)-4-methyl-1-(4-methylphenyl)sulfonyl-3-phenylazetidine-2-carboxylate Traditional Name: (2S,3S,4R)-4-methyl-3-phenyl-1-tosyl-azetidine-2-carboxylic acid ethyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(N1S(=O)(=O)C2=CC=C(C=C2)C)C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO4S/c1-4-25-20(22)19-18(16-8-6-5-7-9-16)15(3)21(19)26(23,24)17-12-10-14(2)11-13-17/h5-13,15,18-19H,4H2,1-3H3/t15-,18-,19+/m1/s1