methyl 4-(2-imidazol-1-ylethanoylamino)benzoate

Systemtic Name: methyl 4-(2-imidazol-1-ylethanoylamino)benzoate Openeye Name: methyl 4-[(2-imidazol-1-ylacetyl)amino]benzoate CAS Name: 4-[[2-(1-imidazolyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-imidazol-1-ylacetyl)amino]benzoate Traditional Name: 4-[(2-imidazol-1-ylacetyl)amino]benzoic acid methyl ester Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C=CN=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C=CN=C2

InChI

InChI=1S/C13H13N3O3/c1-19-13(18)10-2-4-11(5-3-10)15-12(17)8-16-7-6-14-9-16/h2-7,9H,8H2,1H3,(H,15,17)