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

Systemtic Name: 3-[(6-iodanylquinazolin-4-yl)amino]-4-methyl-benzoic acid Openeye Name: 3-[(6-iodoquinazolin-4-yl)amino]-4-methyl-benzoic acid CAS Name: 3-[(6-iodo-4-quinazolinyl)amino]-4-methylbenzoic acid IUPAC Name: 3-[(6-iodoquinazolin-4-yl)amino]-4-methylbenzoic acid Traditional Name: 3-[(6-iodoquinazolin-4-yl)amino]-4-methyl-benzoic acid Formula: C16H12IN3O2 MolecularWeight: 405.18985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC2=NC=NC3=C2C=C(C=C3)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC2=NC=NC3=C2C=C(C=C3)I

InChI

InChI=1S/C16H12IN3O2/c1-9-2-3-10(16(21)22)6-14(9)20-15-12-7-11(17)4-5-13(12)18-8-19-15/h2-8H,1H3,(H,21,22)(H,18,19,20)