4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-hexa-4,5-dienoxy-1H-quinazolin-7-one

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-hexa-4,5-dienoxy-1H-quinazolin-7-one Openeye Name: 4-(3-chloro-4-fluoro-anilino)-6-hexa-4,5-dienoxy-1H-quinazolin-7-one CAS Name: 4-(3-chloro-4-fluoroanilino)-6-hexa-4,5-dienoxy-1H-quinazolin-7-one IUPAC Name: 4-(3-chloro-4-fluoroanilino)-6-hexa-4,5-dienoxy-1H-quinazolin-7-one Traditional Name: 4-(3-chloro-4-fluoro-anilino)-6-hexa-4,5-dienoxy-1H-quinazolin-7-one Formula: C20H17ClFN3O2 MolecularWeight: 385.819283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C=CCCCOC1=CC2=C(N=CNC2=CC1=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C=C=CCCCOC1=CC2=C(N=CNC2=CC1=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H17ClFN3O2/c1-2-3-4-5-8-27-19-10-14-17(11-18(19)26)23-12-24-20(14)25-13-6-7-16(22)15(21)9-13/h3,6-7,9-12,25H,1,4-5,8H2,(H,23,24)