3,4-bis(fluoranyl)-2-[(4-imidazol-1-yl-2-methyl-phenyl)amino]benzoic acid

Systemtic Name: 3,4-bis(fluoranyl)-2-[(4-imidazol-1-yl-2-methyl-phenyl)amino]benzoic acid Openeye Name: 3,4-difluoro-2-(4-imidazol-1-yl-2-methyl-anilino)benzoic acid CAS Name: 3,4-difluoro-2-[4-(1-imidazolyl)-2-methylanilino]benzoic acid IUPAC Name: 3,4-difluoro-2-(4-imidazol-1-yl-2-methylanilino)benzoic acid Traditional Name: 3,4-difluoro-2-(4-imidazol-1-yl-2-methyl-anilino)benzoic acid Formula: C17H13F2N3O2 MolecularWeight: 329.300826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C=CN=C2)NC3=C(C=CC(=C3F)F)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)N2C=CN=C2)NC3=C(C=CC(=C3F)F)C(=O)O

InChI

InChI=1S/C17H13F2N3O2/c1-10-8-11(22-7-6-20-9-22)2-5-14(10)21-16-12(17(23)24)3-4-13(18)15(16)19/h2-9,21H,1H3,(H,23,24)