(E)-2-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-(3-fluorophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-(3-fluorophenyl)prop-2-enenitrile Openeye Name: (E)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)-3-(3-fluorophenyl)prop-2-enenitrile CAS Name: (E)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)-3-(3-fluorophenyl)-2-propenenitrile IUPAC Name: (E)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)-3-(3-fluorophenyl)prop-2-enenitrile Traditional Name: (E)-2-(7-chloro-4-keto-1H-quinazolin-2-yl)-3-(3-fluorophenyl)acrylonitrile Formula: C17H9ClFN3O MolecularWeight: 325.724263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C=C(C#N)C2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)F)/C=C(\C#N)/C2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C17H9ClFN3O/c18-12-4-5-14-15(8-12)21-16(22-17(14)23)11(9-20)6-10-2-1-3-13(19)7-10/h1-8H,(H,21,22,23)/b11-6+