1-nitrooxypropyl (E)-3-azanylbut-2-enoate

Systemtic Name: 1-nitrooxypropyl (E)-3-azanylbut-2-enoate Openeye Name: 1-nitrooxypropyl (E)-3-aminobut-2-enoate CAS Name: (E)-3-amino-2-butenoic acid 1-nitrooxypropyl ester IUPAC Name: 1-nitrooxypropyl (E)-3-aminobut-2-enoate Traditional Name: (E)-3-aminobut-2-enoic acid 1-nitrooxypropyl ester Formula: C7H12N2O5 MolecularWeight: 204.18058

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC(=O)C=C(C)N)O[N+](=O)[O-]

Isomeric SMILES

CCC(OC(=O)/C=C(\C)/N)O[N+](=O)[O-]

InChI

InChI=1S/C7H12N2O5/c1-3-7(14-9(11)12)13-6(10)4-5(2)8/h4,7H,3,8H2,1-2H3/b5-4+