(Z)-2-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)carbonyl-3-oxidanyl-3-phenyl-prop-2-enenitrile

Systemtic Name: (Z)-2-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)carbonyl-3-oxidanyl-3-phenyl-prop-2-enenitrile Openeye Name: (Z)-2-(3-ethyl-2-methyl-5-nitro-imidazole-4-carbonyl)-3-hydroxy-3-phenyl-prop-2-enenitrile CAS Name: (Z)-2-[(3-ethyl-2-methyl-5-nitro-4-imidazolyl)-oxomethyl]-3-hydroxy-3-phenyl-2-propenenitrile IUPAC Name: (Z)-2-(3-ethyl-2-methyl-5-nitroimidazole-4-carbonyl)-3-hydroxy-3-phenylprop-2-enenitrile Traditional Name: (Z)-2-(3-ethyl-2-methyl-5-nitro-imidazole-4-carbonyl)-3-hydroxy-3-phenyl-acrylonitrile Formula: C16H14N4O4 MolecularWeight: 326.30676

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C1C(=O)C(=C(C2=CC=CC=C2)O)C#N)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=NC(=C1C(=O)/C(=C(/C2=CC=CC=C2)\O)/C#N)[N+](=O)[O-])C

InChI

InChI=1S/C16H14N4O4/c1-3-19-10(2)18-16(20(23)24)13(19)15(22)12(9-17)14(21)11-7-5-4-6-8-11/h4-8,21H,3H2,1-2H3/b14-12-