tert-butyl 4-azanyl-3-imidazol-1-yl-benzoate

Systemtic Name: tert-butyl 4-azanyl-3-imidazol-1-yl-benzoate Openeye Name: tert-butyl 4-amino-3-imidazol-1-yl-benzoate CAS Name: 4-amino-3-(1-imidazolyl)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-amino-3-imidazol-1-ylbenzoate Traditional Name: 4-amino-3-imidazol-1-yl-benzoic acid tert-butyl ester Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O2/c1-14(2,3)19-13(18)10-4-5-11(15)12(8-10)17-7-6-16-9-17/h4-9H,15H2,1-3H3