4-[(6-iodanylquinazolin-4-yl)amino]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[(6-iodanylquinazolin-4-yl)amino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[(6-iodoquinazolin-4-yl)amino]benzoic acid CAS Name: 2-hydroxy-4-[(6-iodo-4-quinazolinyl)amino]benzoic acid IUPAC Name: 2-hydroxy-4-[(6-iodoquinazolin-4-yl)amino]benzoic acid Traditional Name: 2-hydroxy-4-[(6-iodoquinazolin-4-yl)amino]benzoic acid Formula: C15H10IN3O3 MolecularWeight: 407.16267

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC=NC3=C2C=C(C=C3)I)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC=NC3=C2C=C(C=C3)I)O)C(=O)O

InChI

InChI=1S/C15H10IN3O3/c16-8-1-4-12-11(5-8)14(18-7-17-12)19-9-2-3-10(15(21)22)13(20)6-9/h1-7,20H,(H,21,22)(H,17,18,19)