6-[4-[(2-fluorophenyl)amino]-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-[(2-fluorophenyl)amino]-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(2-fluoroanilino)-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(2-fluoroanilino)-1H-quinazolin-2-ylidene]-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(2-fluoroanilino)-1H-quinazolin-2-ylidene]-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(2-fluoroanilino)-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C21H16FN3O2 MolecularWeight: 361.369043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C2NC3=CC=CC=C3C(=N2)NC4=CC=CC=C4F)C1=O

Isomeric SMILES

COC1=CC=CC(=C2NC3=CC=CC=C3C(=N2)NC4=CC=CC=C4F)C1=O

InChI

InChI=1S/C21H16FN3O2/c1-27-18-12-6-8-14(19(18)26)21-23-16-10-4-2-7-13(16)20(25-21)24-17-11-5-3-9-15(17)22/h2-12,23H,1H3,(H,24,25)