3-methyl-4-(propylcarbamoylamino)benzoate

Systemtic Name: 3-methyl-4-(propylcarbamoylamino)benzoate Openeye Name: 3-methyl-4-(propylcarbamoylamino)benzoate CAS Name: 3-methyl-4-[[oxo(propylamino)methyl]amino]benzoate IUPAC Name: 3-methyl-4-(propylcarbamoylamino)benzoate Traditional Name: 3-methyl-4-(propylcarbamoylamino)benzoate Formula: C12H15N2O3- MolecularWeight: 235.2591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC1=C(C=C(C=C1)C(=O)[O-])C

Isomeric SMILES

CCCNC(=O)NC1=C(C=C(C=C1)C(=O)[O-])C

InChI

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