prop-2-enyl 2-acetamido-3-(5-nitro-1-prop-2-enyl-imidazol-4-yl)propanoate

Systemtic Name: prop-2-enyl 2-acetamido-3-(5-nitro-1-prop-2-enyl-imidazol-4-yl)propanoate Openeye Name: allyl 2-acetamido-3-(1-allyl-5-nitro-imidazol-4-yl)propanoate CAS Name: 2-acetamido-3-(5-nitro-1-prop-2-enyl-4-imidazolyl)propanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-acetamido-3-(5-nitro-1-prop-2-enylimidazol-4-yl)propanoate Traditional Name: 2-acetamido-3-(1-allyl-5-nitro-imidazol-4-yl)propionic acid allyl ester Formula: C14H18N4O5 MolecularWeight: 322.31652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=C(N(C=N1)CC=C)[N+](=O)[O-])C(=O)OCC=C

Isomeric SMILES

CC(=O)NC(CC1=C(N(C=N1)CC=C)[N+](=O)[O-])C(=O)OCC=C

InChI

InChI=1S/C14H18N4O5/c1-4-6-17-9-15-11(13(17)18(21)22)8-12(16-10(3)19)14(20)23-7-5-2/h4-5,9,12H,1-2,6-8H2,3H3,(H,16,19)