4-[N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]benzoate

Systemtic Name: 4-[N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]benzoate Openeye Name: 4-(N'-tert-butoxycarbonylcarbamimidoyl)benzoate CAS Name: 4-[amino-[(2-methylpropan-2-yl)oxy-oxomethyl]iminomethyl]benzoate IUPAC Name: 4-[N'-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]benzoate Traditional Name: 4-(N'-tert-butoxycarbonylamidino)benzoate Formula: C13H15N2O4- MolecularWeight: 263.2692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N=C(C1=CC=C(C=C1)C(=O)[O-])N

Isomeric SMILES

CC(C)(C)OC(=O)N=C(C1=CC=C(C=C1)C(=O)[O-])N

InChI

InChI=1S/C13H16N2O4/c1-13(2,3)19-12(18)15-10(14)8-4-6-9(7-5-8)11(16)17/h4-7H,1-3H3,(H,16,17)(H2,14,15,18)/p-1