(E)-2-(4-oxidanylidene-1H-quinazolin-2-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(4-oxidanylidene-1H-quinazolin-2-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-enenitrile Openeye Name: (E)-2-(4-oxo-1H-quinazolin-2-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-enenitrile CAS Name: (E)-2-(4-oxo-1H-quinazolin-2-yl)-3-[3-(trifluoromethyl)phenyl]-2-propenenitrile IUPAC Name: (E)-2-(4-oxo-1H-quinazolin-2-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-enenitrile Traditional Name: (E)-2-(4-keto-1H-quinazolin-2-yl)-3-[3-(trifluoromethyl)phenyl]acrylonitrile Formula: C18H10F3N3O MolecularWeight: 341.28671

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=CC3=CC(=CC=C3)C(F)(F)F)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)/C(=C/C3=CC(=CC=C3)C(F)(F)F)/C#N

InChI

InChI=1S/C18H10F3N3O/c19-18(20,21)13-5-3-4-11(9-13)8-12(10-22)16-23-15-7-2-1-6-14(15)17(25)24-16/h1-9H,(H,23,24,25)/b12-8+