3-methyl-2-(propylcarbamoylamino)benzoic acid

Systemtic Name: 3-methyl-2-(propylcarbamoylamino)benzoic acid Openeye Name: 3-methyl-2-(propylcarbamoylamino)benzoic acid CAS Name: 3-methyl-2-[[oxo(propylamino)methyl]amino]benzoic acid IUPAC Name: 3-methyl-2-(propylcarbamoylamino)benzoic acid Traditional Name: 3-methyl-2-(propylcarbamoylamino)benzoic acid Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC1=C(C=CC=C1C)C(=O)O

Isomeric SMILES

CCCNC(=O)NC1=C(C=CC=C1C)C(=O)O

InChI

InChI=1S/C12H16N2O3/c1-3-7-13-12(17)14-10-8(2)5-4-6-9(10)11(15)16/h4-6H,3,7H2,1-2H3,(H,15,16)(H2,13,14,17)