(E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-(4-fluorophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-(4-fluorophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-(4-fluorobenzoyl)prop-2-enenitrile CAS Name: (E)-3-(4,5-dimethoxy-2-nitrophenyl)-2-[(4-fluorophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(4,5-dimethoxy-2-nitrophenyl)-2-(4-fluorobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-(4-fluorobenzoyl)acrylonitrile Formula: C18H13FN2O5 MolecularWeight: 356.304623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C(=O)C2=CC=C(C=C2)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(\C#N)/C(=O)C2=CC=C(C=C2)F)[N+](=O)[O-])OC

InChI

InChI=1S/C18H13FN2O5/c1-25-16-8-12(15(21(23)24)9-17(16)26-2)7-13(10-20)18(22)11-3-5-14(19)6-4-11/h3-9H,1-2H3/b13-7+