tert-butyl 5-azanyl-2-carbamimidoyl-benzoate

Systemtic Name: tert-butyl 5-azanyl-2-carbamimidoyl-benzoate Openeye Name: tert-butyl 5-amino-2-carbamimidoyl-benzoate CAS Name: 5-amino-2-carbamimidoylbenzoic acid tert-butyl ester IUPAC Name: tert-butyl 5-amino-2-carbamimidoylbenzoate Traditional Name: 2-amidino-5-amino-benzoic acid tert-butyl ester Formula: C12H17N3O2 MolecularWeight: 235.28228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC(=C1)N)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC(=C1)N)C(=N)N

InChI

InChI=1S/C12H17N3O2/c1-12(2,3)17-11(16)9-6-7(13)4-5-8(9)10(14)15/h4-6H,13H2,1-3H3,(H3,14,15)