3-(4-fluorophenyl)-4-oxidanylidene-1'-phenyl-spiro[1H-quinazoline-2,4'-cyclohexane]-1'-carbonitrile

Systemtic Name: 3-(4-fluorophenyl)-4-oxidanylidene-1'-phenyl-spiro[1H-quinazoline-2,4'-cyclohexane]-1'-carbonitrile Openeye Name: 3-(4-fluorophenyl)-4-oxo-1'-phenyl-spiro[1H-quinazoline-2,4'-cyclohexane]-1'-carbonitrile CAS Name: 3-(4-fluorophenyl)-4-oxo-1'-phenyl-1'-spiro[1H-quinazoline-2,4'-cyclohexane]carbonitrile IUPAC Name: 3-(4-fluorophenyl)-4-oxo-1'-phenylspiro[1H-quinazoline-2,4'-cyclohexane]-1'-carbonitrile Traditional Name: 3-(4-fluorophenyl)-4-keto-1'-phenyl-spiro[1H-quinazoline-2,4'-cyclohexane]-1'-carbonitrile Formula: C26H22FN3O MolecularWeight: 411.470783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1(C#N)C3=CC=CC=C3)NC4=CC=CC=C4C(=O)N2C5=CC=C(C=C5)F

Isomeric SMILES

C1CC2(CCC1(C#N)C3=CC=CC=C3)NC4=CC=CC=C4C(=O)N2C5=CC=C(C=C5)F

InChI

InChI=1S/C26H22FN3O/c27-20-10-12-21(13-11-20)30-24(31)22-8-4-5-9-23(22)29-26(30)16-14-25(18-28,15-17-26)19-6-2-1-3-7-19/h1-13,29H,14-17H2