3-[(6-iodanylquinazolin-4-yl)amino]benzoic acid

Systemtic Name: 3-[(6-iodanylquinazolin-4-yl)amino]benzoic acid Openeye Name: 3-[(6-iodoquinazolin-4-yl)amino]benzoic acid CAS Name: 3-[(6-iodo-4-quinazolinyl)amino]benzoic acid IUPAC Name: 3-[(6-iodoquinazolin-4-yl)amino]benzoic acid Traditional Name: 3-[(6-iodoquinazolin-4-yl)amino]benzoic acid Formula: C15H10IN3O2 MolecularWeight: 391.16327

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)I)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)I)C(=O)O

InChI

InChI=1S/C15H10IN3O2/c16-10-4-5-13-12(7-10)14(18-8-17-13)19-11-3-1-2-9(6-11)15(20)21/h1-8H,(H,20,21)(H,17,18,19)