3-(4-chloranyl-2-nitro-phenyl)-6-iodanyl-2-[2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one

Systemtic Name: 3-(4-chloranyl-2-nitro-phenyl)-6-iodanyl-2-[2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one Openeye Name: 3-(4-chloro-2-nitro-phenyl)-6-iodo-2-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one CAS Name: 3-(4-chloro-2-nitrophenyl)-6-iodo-2-[2-(4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-1H-quinazolin-4-one IUPAC Name: 3-(4-chloro-2-nitrophenyl)-6-iodo-2-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one Traditional Name: 3-(4-chloro-2-nitro-phenyl)-6-iodo-2-[2-(4-ketocyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one Formula: C22H13ClIN3O4 MolecularWeight: 545.71379

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=CC=C2NC3=C(C=C(C=C3)I)C(=O)N2C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C=CC1=CC=C2NC3=C(C=C(C=C3)I)C(=O)N2C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H13ClIN3O4/c23-14-4-9-19(20(11-14)27(30)31)26-21(10-3-13-1-6-16(28)7-2-13)25-18-8-5-15(24)12-17(18)22(26)29/h1-12,25H