ethyl (2S,3S)-2-ethyl-2-nitro-3-phenethyl-aziridine-1-carboxylate

Systemtic Name: ethyl (2S,3S)-2-ethyl-2-nitro-3-phenethyl-aziridine-1-carboxylate Openeye Name: ethyl (2S,3S)-2-ethyl-2-nitro-3-phenethyl-aziridine-1-carboxylate CAS Name: (2S,3S)-2-ethyl-2-nitro-3-phenethyl-1-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3S)-2-ethyl-2-nitro-3-phenethylaziridine-1-carboxylate Traditional Name: (2S,3S)-2-ethyl-2-nitro-3-phenethyl-ethylenimine-1-carboxylic acid ethyl ester Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N1C(=O)OCC)CCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC[C@@]1([C@@H](N1C(=O)OCC)CCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O4/c1-3-15(17(19)20)13(16(15)14(18)21-4-2)11-10-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3/t13-,15-,16?/m0/s1