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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C#N)C2=NC(=O)C3=C(N2)C=C(C=C3)Cl)F

Isomeric SMILES

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

InChI

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