6-[4-(4-tert-butyl-2-chloranyl-phenoxy)-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-(4-tert-butyl-2-chloranyl-phenoxy)-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(4-tert-butyl-2-chloro-phenoxy)-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(4-tert-butyl-2-chlorophenoxy)-1H-quinazolin-2-ylidene]-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(4-tert-butyl-2-chlorophenoxy)-1H-quinazolin-2-ylidene]-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(4-tert-butyl-2-chloro-phenoxy)-1H-quinazolin-2-ylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C25H23ClN2O3 MolecularWeight: 434.91472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC2=NC(=C3C=CC=C(C3=O)OC)NC4=CC=CC=C42)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC2=NC(=C3C=CC=C(C3=O)OC)NC4=CC=CC=C42)Cl

InChI

InChI=1S/C25H23ClN2O3/c1-25(2,3)15-12-13-20(18(26)14-15)31-24-16-8-5-6-10-19(16)27-23(28-24)17-9-7-11-21(30-4)22(17)29/h5-14,27H,1-4H3