ethyl 3-azanyl-4-imidazol-1-yl-benzoate

Systemtic Name: ethyl 3-azanyl-4-imidazol-1-yl-benzoate Openeye Name: ethyl 3-amino-4-imidazol-1-yl-benzoate CAS Name: 3-amino-4-(1-imidazolyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-amino-4-imidazol-1-ylbenzoate Traditional Name: 3-amino-4-imidazol-1-yl-benzoic acid ethyl ester Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2C=CN=C2)N

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2C=CN=C2)N

InChI

InChI=1S/C12H13N3O2/c1-2-17-12(16)9-3-4-11(10(13)7-9)15-6-5-14-8-15/h3-8H,2,13H2,1H3