2-ethyl-4-(2-methylpropanoylamino)benzoic acid

Systemtic Name: 2-ethyl-4-(2-methylpropanoylamino)benzoic acid Openeye Name: 2-ethyl-4-(2-methylpropanoylamino)benzoic acid CAS Name: 2-ethyl-4-[(2-methyl-1-oxopropyl)amino]benzoic acid IUPAC Name: 2-ethyl-4-(2-methylpropanoylamino)benzoic acid Traditional Name: 2-ethyl-4-(isobutyrylamino)benzoic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)NC(=O)C(C)C)C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)NC(=O)C(C)C)C(=O)O

InChI

InChI=1S/C13H17NO3/c1-4-9-7-10(14-12(15)8(2)3)5-6-11(9)13(16)17/h5-8H,4H2,1-3H3,(H,14,15)(H,16,17)