ethyl (2R,3R)-1-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)aziridine-2-carboxylate

Systemtic Name: ethyl (2R,3R)-1-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)aziridine-2-carboxylate Openeye Name: ethyl (2R,3R)-3-(4-nitrophenyl)-1-(p-tolylsulfonyl)aziridine-2-carboxylate CAS Name: (2R,3R)-1-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-1-(4-methylphenyl)sulfonyl-3-(4-nitrophenyl)aziridine-2-carboxylate Traditional Name: (2R,3R)-3-(4-nitrophenyl)-1-tosyl-ethylenimine-2-carboxylic acid ethyl ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O6S/c1-3-26-18(21)17-16(13-6-8-14(9-7-13)20(22)23)19(17)27(24,25)15-10-4-12(2)5-11-15/h4-11,16-17H,3H2,1-2H3/t16-,17-,19?/m1/s1