6-[4-[(5-chloranyl-2-methoxy-phenyl)amino]-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-[(5-chloranyl-2-methoxy-phenyl)amino]-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(5-chloro-2-methoxy-anilino)-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(5-chloro-2-methoxyanilino)-1H-quinazolin-2-ylidene]-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(5-chloro-2-methoxyanilino)-1H-quinazolin-2-ylidene]-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(5-chloro-2-methoxy-anilino)-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C22H18ClN3O3 MolecularWeight: 407.84962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC2=NC(=C3C=CC=C(C3=O)OC)NC4=CC=CC=C42

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC2=NC(=C3C=CC=C(C3=O)OC)NC4=CC=CC=C42

InChI

InChI=1S/C22H18ClN3O3/c1-28-18-11-10-13(23)12-17(18)25-21-14-6-3-4-8-16(14)24-22(26-21)15-7-5-9-19(29-2)20(15)27/h3-12,24H,1-2H3,(H,25,26)