5-methyl-2-(4-methylpentanoylamino)benzoic acid

Systemtic Name: 5-methyl-2-(4-methylpentanoylamino)benzoic acid Openeye Name: 5-methyl-2-(4-methylpentanoylamino)benzoic acid CAS Name: 5-methyl-2-[(4-methyl-1-oxopentyl)amino]benzoic acid IUPAC Name: 5-methyl-2-(4-methylpentanoylamino)benzoic acid Traditional Name: 5-methyl-2-(4-methylpentanoylamino)benzoic acid Formula: C14H19NO3 MolecularWeight: 249.30556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3/c1-9(2)4-7-13(16)15-12-6-5-10(3)8-11(12)14(17)18/h5-6,8-9H,4,7H2,1-3H3,(H,15,16)(H,17,18)