4-acetamido-3-imidazol-1-yl-benzoic acid

Systemtic Name: 4-acetamido-3-imidazol-1-yl-benzoic acid Openeye Name: 4-acetamido-3-imidazol-1-yl-benzoic acid CAS Name: 4-acetamido-3-(1-imidazolyl)benzoic acid IUPAC Name: 4-acetamido-3-imidazol-1-ylbenzoic acid Traditional Name: 4-acetamido-3-imidazol-1-yl-benzoic acid Formula: C12H11N3O3 MolecularWeight: 245.23404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)C(=O)O)N2C=CN=C2

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)C(=O)O)N2C=CN=C2

InChI

InChI=1S/C12H11N3O3/c1-8(16)14-10-3-2-9(12(17)18)6-11(10)15-5-4-13-7-15/h2-7H,1H3,(H,14,16)(H,17,18)