5-[7-fluoranyl-4-[4-phenylmethoxy-3-(trifluoromethyl)phenyl]quinazolin-6-yl]furan-2-carbaldehyde

Systemtic Name: 5-[7-fluoranyl-4-[4-phenylmethoxy-3-(trifluoromethyl)phenyl]quinazolin-6-yl]furan-2-carbaldehyde Openeye Name: 5-[4-[4-benzyloxy-3-(trifluoromethyl)phenyl]-7-fluoro-quinazolin-6-yl]furan-2-carbaldehyde CAS Name: 5-[7-fluoro-4-[4-phenylmethoxy-3-(trifluoromethyl)phenyl]-6-quinazolinyl]-2-furancarboxaldehyde IUPAC Name: 5-[7-fluoro-4-[4-phenylmethoxy-3-(trifluoromethyl)phenyl]quinazolin-6-yl]furan-2-carbaldehyde Traditional Name: 5-[4-[4-benzoxy-3-(trifluoromethyl)phenyl]-7-fluoro-quinazolin-6-yl]furfural Formula: C27H16F4N2O3 MolecularWeight: 492.421153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=NC=NC4=CC(=C(C=C43)C5=CC=C(O5)C=O)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=NC=NC4=CC(=C(C=C43)C5=CC=C(O5)C=O)F)C(F)(F)F

InChI

InChI=1S/C27H16F4N2O3/c28-22-12-23-20(11-19(22)24-9-7-18(13-34)36-24)26(33-15-32-23)17-6-8-25(21(10-17)27(29,30)31)35-14-16-4-2-1-3-5-16/h1-13,15H,14H2