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

Systemtic Name: 6-azanyl-2-methyl-3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoic acid Openeye Name: 6-amino-3-[(tert-butoxycarbonylamino)methyl]-2-methyl-benzoic acid CAS Name: 6-amino-2-methyl-3-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 6-amino-2-methyl-3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoic acid Traditional Name: 6-amino-3-[(tert-butoxycarbonylamino)methyl]-2-methyl-benzoic acid Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C(=O)O)N)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1C(=O)O)N)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C14H20N2O4/c1-8-9(5-6-10(15)11(8)12(17)18)7-16-13(19)20-14(2,3)4/h5-6H,7,15H2,1-4H3,(H,16,19)(H,17,18)