(E)-3-(4-ethyl-3-nitro-phenyl)-2-(2-fluorophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(4-ethyl-3-nitro-phenyl)-2-(2-fluorophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-ethyl-3-nitro-phenyl)-2-(2-fluorobenzoyl)prop-2-enenitrile CAS Name: (E)-3-(4-ethyl-3-nitrophenyl)-2-[(2-fluorophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(4-ethyl-3-nitrophenyl)-2-(2-fluorobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(4-ethyl-3-nitro-phenyl)-2-(2-fluorobenzoyl)acrylonitrile Formula: C18H13FN2O3 MolecularWeight: 324.305823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C=C(C#N)C(=O)C2=CC=CC=C2F)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)C2=CC=CC=C2F)[N+](=O)[O-]

InChI

InChI=1S/C18H13FN2O3/c1-2-13-8-7-12(10-17(13)21(23)24)9-14(11-20)18(22)15-5-3-4-6-16(15)19/h3-10H,2H2,1H3/b14-9+