4-[6-iodanyl-4-oxidanylidene-2-[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)ethylidene]-1H-quinazolin-3-yl]benzoic acid

Systemtic Name: 4-[6-iodanyl-4-oxidanylidene-2-[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)ethylidene]-1H-quinazolin-3-yl]benzoic acid Openeye Name: 4-[6-iodo-4-oxo-2-[2-(6-oxocyclohexa-2,4-dien-1-ylidene)ethylidene]-1H-quinazolin-3-yl]benzoic acid CAS Name: 4-[6-iodo-4-oxo-2-[2-(6-oxo-1-cyclohexa-2,4-dienylidene)ethylidene]-1H-quinazolin-3-yl]benzoic acid IUPAC Name: 4-[6-iodo-4-oxo-2-[2-(6-oxocyclohexa-2,4-dien-1-ylidene)ethylidene]-1H-quinazolin-3-yl]benzoic acid Traditional Name: 4-[6-iodo-4-keto-2-[2-(6-ketocyclohexa-2,4-dien-1-ylidene)ethylidene]-1H-quinazolin-3-yl]benzoic acid Formula: C23H15IN2O4 MolecularWeight: 510.28067

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C2NC3=C(C=C(C=C3)I)C(=O)N2C4=CC=C(C=C4)C(=O)O)C(=O)C=C1

Isomeric SMILES

C1=CC(=CC=C2NC3=C(C=C(C=C3)I)C(=O)N2C4=CC=C(C=C4)C(=O)O)C(=O)C=C1

InChI

InChI=1S/C23H15IN2O4/c24-16-8-11-19-18(13-16)22(28)26(17-9-5-15(6-10-17)23(29)30)21(25-19)12-7-14-3-1-2-4-20(14)27/h1-13,25H,(H,29,30)