O2-methyl O1-[(4-nitrophenyl)methyl] (2S)-aziridine-1,2-dicarboxylate

Systemtic Name: O2-methyl O1-[(4-nitrophenyl)methyl] (2S)-aziridine-1,2-dicarboxylate Openeye Name: O2-methyl O1-[(4-nitrophenyl)methyl] (2S)-aziridine-1,2-dicarboxylate CAS Name: (2S)-aziridine-1,2-dicarboxylic acid O2-methyl ester O1-[(4-nitrophenyl)methyl] ester IUPAC Name: 2-O-methyl 1-O-[(4-nitrophenyl)methyl] (2S)-aziridine-1,2-dicarboxylate Traditional Name: (2S)-ethylenimine-1,2-dicarboxylic acid O2-methyl ester O1-(4-nitrobenzyl) ester Formula: C12H12N2O6 MolecularWeight: 280.23348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@@H]1CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O6/c1-19-11(15)10-6-13(10)12(16)20-7-8-2-4-9(5-3-8)14(17)18/h2-5,10H,6-7H2,1H3/t10-,13?/m0/s1