3-azanyl-2-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid

Systemtic Name: 3-azanyl-2-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid Openeye Name: 3-amino-5-(tert-butoxycarbonylamino)-2-methyl-benzoic acid CAS Name: 3-amino-2-methyl-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid IUPAC Name: 3-amino-2-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid Traditional Name: 3-amino-5-(tert-butoxycarbonylamino)-2-methyl-benzoic acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)O)NC(=O)OC(C)(C)C)N

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)O)NC(=O)OC(C)(C)C)N

InChI

InChI=1S/C13H18N2O4/c1-7-9(11(16)17)5-8(6-10(7)14)15-12(18)19-13(2,3)4/h5-6H,14H2,1-4H3,(H,15,18)(H,16,17)