5-methyl-2-(2-methylpropoxycarbonylamino)benzoic acid

Systemtic Name: 5-methyl-2-(2-methylpropoxycarbonylamino)benzoic acid Openeye Name: 2-(isobutoxycarbonylamino)-5-methyl-benzoic acid CAS Name: 5-methyl-2-[[2-methylpropoxy(oxo)methyl]amino]benzoic acid IUPAC Name: 5-methyl-2-(2-methylpropoxycarbonylamino)benzoic acid Traditional Name: 2-(isobutoxycarbonylamino)-5-methyl-benzoic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)OCC(C)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)OCC(C)C)C(=O)O

InChI

InChI=1S/C13H17NO4/c1-8(2)7-18-13(17)14-11-5-4-9(3)6-10(11)12(15)16/h4-6,8H,7H2,1-3H3,(H,14,17)(H,15,16)