1H-imidazol-5-yl 3-aminocarbonyl-4-ethanoyl-benzoate

Systemtic Name: 1H-imidazol-5-yl 3-aminocarbonyl-4-ethanoyl-benzoate Openeye Name: 1H-imidazol-5-yl 4-acetyl-3-carbamoyl-benzoate CAS Name: 4-acetyl-3-carbamoylbenzoic acid 1H-imidazol-5-yl ester IUPAC Name: 1H-imidazol-5-yl 4-acetyl-3-carbamoylbenzoate Traditional Name: 4-acetyl-3-carbamoyl-benzoic acid 1H-imidazol-5-yl ester Formula: C13H11N3O4 MolecularWeight: 273.24414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)C(=O)OC2=CN=CN2)C(=O)N

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)C(=O)OC2=CN=CN2)C(=O)N

InChI

InChI=1S/C13H11N3O4/c1-7(17)9-3-2-8(4-10(9)12(14)18)13(19)20-11-5-15-6-16-11/h2-6H,1H3,(H2,14,18)(H,15,16)