(E)-3-(3-chloranyl-5-ethoxy-4-oxidanyl-phenyl)-2-(4-fluorophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-chloranyl-5-ethoxy-4-oxidanyl-phenyl)-2-(4-fluorophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-2-(4-fluorobenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2-[(4-fluorophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2-(4-fluorobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-2-(4-fluorobenzoyl)acrylonitrile Formula: C18H13ClFNO3 MolecularWeight: 345.752123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)C2=CC=C(C=C2)F)Cl)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)C2=CC=C(C=C2)F)Cl)O

InChI

InChI=1S/C18H13ClFNO3/c1-2-24-16-9-11(8-15(19)18(16)23)7-13(10-21)17(22)12-3-5-14(20)6-4-12/h3-9,23H,2H2,1H3/b13-7+