methyl (2S,3R)-1-[(4-chlorophenyl)methyl]-3-(3-nitrophenyl)aziridine-2-carboxylate

Systemtic Name: methyl (2S,3R)-1-[(4-chlorophenyl)methyl]-3-(3-nitrophenyl)aziridine-2-carboxylate Openeye Name: methyl (2S,3R)-1-[(4-chlorophenyl)methyl]-3-(3-nitrophenyl)aziridine-2-carboxylate CAS Name: (2S,3R)-1-[(4-chlorophenyl)methyl]-3-(3-nitrophenyl)-2-aziridinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3R)-1-[(4-chlorophenyl)methyl]-3-(3-nitrophenyl)aziridine-2-carboxylate Traditional Name: (2S,3R)-1-(4-chlorobenzyl)-3-(3-nitrophenyl)ethylenimine-2-carboxylic acid methyl ester Formula: C17H15ClN2O4 MolecularWeight: 346.765

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(N1CC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@@H]1[C@H](N1CC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15ClN2O4/c1-24-17(21)16-15(12-3-2-4-14(9-12)20(22)23)19(16)10-11-5-7-13(18)8-6-11/h2-9,15-16H,10H2,1H3/t15-,16+,19?/m1/s1