4-fluoranyl-5-[(4-iodanyl-2-methyl-phenyl)amino]-1,3-benzoxazole-6-carboxylic acid

Systemtic Name: 4-fluoranyl-5-[(4-iodanyl-2-methyl-phenyl)amino]-1,3-benzoxazole-6-carboxylic acid Openeye Name: 4-fluoro-5-(4-iodo-2-methyl-anilino)-1,3-benzoxazole-6-carboxylic acid CAS Name: 4-fluoro-5-(4-iodo-2-methylanilino)-1,3-benzoxazole-6-carboxylic acid IUPAC Name: 4-fluoro-5-(4-iodo-2-methylanilino)-1,3-benzoxazole-6-carboxylic acid Traditional Name: 4-fluoro-5-(4-iodo-2-methyl-anilino)-1,3-benzoxazole-6-carboxylic acid Formula: C15H10FIN2O3 MolecularWeight: 412.154373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C3=C(C=C2C(=O)O)OC=N3)F

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C3=C(C=C2C(=O)O)OC=N3)F

InChI

InChI=1S/C15H10FIN2O3/c1-7-4-8(17)2-3-10(7)19-13-9(15(20)21)5-11-14(12(13)16)18-6-22-11/h2-6,19H,1H3,(H,20,21)