tert-butyl 3-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-aziridine-2-carboxylate

Systemtic Name: tert-butyl 3-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-aziridine-2-carboxylate Openeye Name: tert-butyl 3-(4-fluorophenyl)-1-(p-tolylsulfonyl)aziridine-2-carboxylate CAS Name: 3-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-2-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-fluorophenyl)-1-(4-methylphenyl)sulfonylaziridine-2-carboxylate Traditional Name: 3-(4-fluorophenyl)-1-tosyl-ethylenimine-2-carboxylic acid tert-butyl ester Formula: C20H22FNO4S MolecularWeight: 391.456383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C2C(=O)OC(C)(C)C)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(C2C(=O)OC(C)(C)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FNO4S/c1-13-5-11-16(12-6-13)27(24,25)22-17(14-7-9-15(21)10-8-14)18(22)19(23)26-20(2,3)4/h5-12,17-18H,1-4H3