2-(3-methylbutylcarbamoyl)benzoic acid

Systemtic Name: 2-(3-methylbutylcarbamoyl)benzoic acid Openeye Name: 2-(isopentylcarbamoyl)benzoic acid CAS Name: 2-[(3-methylbutylamino)-oxomethyl]benzoic acid IUPAC Name: 2-(3-methylbutylcarbamoyl)benzoic acid Traditional Name: 2-(isoamylcarbamoyl)benzoic acid Formula: C13H17NO3 MolecularWeight: 235.27898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(C)CCNC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C13H17NO3/c1-9(2)7-8-14-12(15)10-5-3-4-6-11(10)13(16)17/h3-6,9H,7-8H2,1-2H3,(H,14,15)(H,16,17)