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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)C2=CC=CC=C2F)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)C2=CC=CC=C2F)Cl)OC

InChI

InChI=1S/C18H13ClFNO3/c1-23-16-9-11(8-14(19)18(16)24-2)7-12(10-21)17(22)13-5-3-4-6-15(13)20/h3-9H,1-2H3/b12-7+