3-[methyl(2-methylbutyl)carbamoyl]benzoic acid

Systemtic Name: 3-[methyl(2-methylbutyl)carbamoyl]benzoic acid Openeye Name: 3-[methyl(2-methylbutyl)carbamoyl]benzoic acid CAS Name: 3-[[methyl(2-methylbutyl)amino]-oxomethyl]benzoic acid IUPAC Name: 3-[methyl(2-methylbutyl)carbamoyl]benzoic acid Traditional Name: 3-[methyl(2-methylbutyl)carbamoyl]benzoic acid Formula: C14H19NO3 MolecularWeight: 249.30556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN(C)C(=O)C1=CC(=CC=C1)C(=O)O

Isomeric SMILES

CCC(C)CN(C)C(=O)C1=CC(=CC=C1)C(=O)O

InChI

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