(E)-3-(2-imidazol-1-yl-5-nitro-phenyl)prop-2-enoate

Systemtic Name: (E)-3-(2-imidazol-1-yl-5-nitro-phenyl)prop-2-enoate Openeye Name: (E)-3-(2-imidazol-1-yl-5-nitro-phenyl)prop-2-enoate CAS Name: (E)-3-[2-(1-imidazolyl)-5-nitrophenyl]-2-propenoate IUPAC Name: (E)-3-(2-imidazol-1-yl-5-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(2-imidazol-1-yl-5-nitro-phenyl)acrylate Formula: C12H8N3O4- MolecularWeight: 258.20962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C=CC(=O)[O-])N2C=CN=C2

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])/C=C/C(=O)[O-])N2C=CN=C2

InChI

InChI=1S/C12H9N3O4/c16-12(17)4-1-9-7-10(15(18)19)2-3-11(9)14-6-5-13-8-14/h1-8H,(H,16,17)/p-1/b4-1+