tert-butyl 4-azanyl-3-(2-azanylimidazol-1-yl)benzoate

Systemtic Name: tert-butyl 4-azanyl-3-(2-azanylimidazol-1-yl)benzoate Openeye Name: tert-butyl 4-amino-3-(2-aminoimidazol-1-yl)benzoate CAS Name: 4-amino-3-(2-amino-1-imidazolyl)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-amino-3-(2-aminoimidazol-1-yl)benzoate Traditional Name: 4-amino-3-(2-aminoimidazol-1-yl)benzoic acid tert-butyl ester Formula: C14H18N4O2 MolecularWeight: 274.31832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)N)N2C=CN=C2N

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)N)N2C=CN=C2N

InChI

InChI=1S/C14H18N4O2/c1-14(2,3)20-12(19)9-4-5-10(15)11(8-9)18-7-6-17-13(18)16/h4-8H,15H2,1-3H3,(H2,16,17)