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

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-hepta-5,6-dienoxy-1H-quinazolin-7-one Openeye Name: 4-(3-chloro-4-fluoro-anilino)-6-hepta-5,6-dienoxy-1H-quinazolin-7-one CAS Name: 4-(3-chloro-4-fluoroanilino)-6-hepta-5,6-dienoxy-1H-quinazolin-7-one IUPAC Name: 4-(3-chloro-4-fluoroanilino)-6-hepta-5,6-dienoxy-1H-quinazolin-7-one Traditional Name: 4-(3-chloro-4-fluoro-anilino)-6-hepta-5,6-dienoxy-1H-quinazolin-7-one Formula: C21H19ClFN3O2 MolecularWeight: 399.845863

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Descriptors Computed from Structure

Canonical SMILES:

C=C=CCCCCOC1=CC2=C(N=CNC2=CC1=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C=C=CCCCCOC1=CC2=C(N=CNC2=CC1=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H19ClFN3O2/c1-2-3-4-5-6-9-28-20-11-15-18(12-19(20)27)24-13-25-21(15)26-14-7-8-17(23)16(22)10-14/h3,7-8,10-13,26H,1,4-6,9H2,(H,24,25)