tert-butyl (2S,3R)-2-[(4-methylphenyl)sulfonyloxymethyl]-3-phenyl-aziridine-1-carboxylate

Systemtic Name: tert-butyl (2S,3R)-2-[(4-methylphenyl)sulfonyloxymethyl]-3-phenyl-aziridine-1-carboxylate Openeye Name: tert-butyl (2R,3S)-2-phenyl-3-(p-tolylsulfonyloxymethyl)aziridine-1-carboxylate CAS Name: (2S,3R)-2-[(4-methylphenyl)sulfonyloxymethyl]-3-phenyl-1-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-2-[(4-methylphenyl)sulfonyloxymethyl]-3-phenylaziridine-1-carboxylate Traditional Name: (2R,3S)-2-phenyl-3-(tosyloxymethyl)ethylenimine-1-carboxylic acid tert-butyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(N2C(=O)OC(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2[C@H](N2C(=O)OC(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO5S/c1-15-10-12-17(13-11-15)28(24,25)26-14-18-19(16-8-6-5-7-9-16)22(18)20(23)27-21(2,3)4/h5-13,18-19H,14H2,1-4H3/t18-,19-,22?/m1/s1