tert-butyl (2R,3S)-2-methyl-1-(4-methylphenyl)sulfonyl-3-phenyl-aziridine-2-carboxylate

Systemtic Name: tert-butyl (2R,3S)-2-methyl-1-(4-methylphenyl)sulfonyl-3-phenyl-aziridine-2-carboxylate Openeye Name: tert-butyl (2R,3S)-2-methyl-3-phenyl-1-(p-tolylsulfonyl)aziridine-2-carboxylate CAS Name: (2R,3S)-2-methyl-1-(4-methylphenyl)sulfonyl-3-phenyl-2-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3S)-2-methyl-1-(4-methylphenyl)sulfonyl-3-phenylaziridine-2-carboxylate Traditional Name: (2R,3S)-2-methyl-3-phenyl-1-tosyl-ethylenimine-2-carboxylic acid tert-butyl ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C2(C)C(=O)OC(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@H]([C@]2(C)C(=O)OC(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO4S/c1-15-11-13-17(14-12-15)27(24,25)22-18(16-9-7-6-8-10-16)21(22,5)19(23)26-20(2,3)4/h6-14,18H,1-5H3/t18-,21+,22?/m0/s1