ethyl (2R,3S)-2-but-3-enyl-3-hexyl-2-nitro-aziridine-1-carboxylate

Systemtic Name: ethyl (2R,3S)-2-but-3-enyl-3-hexyl-2-nitro-aziridine-1-carboxylate Openeye Name: ethyl (2R,3S)-2-but-3-enyl-3-hexyl-2-nitro-aziridine-1-carboxylate CAS Name: (2R,3S)-2-but-3-enyl-3-hexyl-2-nitro-1-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3S)-2-but-3-enyl-3-hexyl-2-nitroaziridine-1-carboxylate Traditional Name: (2R,3S)-2-but-3-enyl-3-hexyl-2-nitro-ethylenimine-1-carboxylic acid ethyl ester Formula: C15H26N2O4 MolecularWeight: 298.37794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(N1C(=O)OCC)(CCC=C)[N+](=O)[O-]

Isomeric SMILES

CCCCCC[C@H]1[C@@](N1C(=O)OCC)(CCC=C)[N+](=O)[O-]

InChI

InChI=1S/C15H26N2O4/c1-4-7-9-10-11-13-15(17(19)20,12-8-5-2)16(13)14(18)21-6-3/h5,13H,2,4,6-12H2,1,3H3/t13-,15+,16?/m0/s1