2-aminocarbonyl-3-octyl-benzoic acid

Systemtic Name: 2-aminocarbonyl-3-octyl-benzoic acid Openeye Name: 2-carbamoyl-3-octyl-benzoic acid CAS Name: 2-carbamoyl-3-octylbenzoic acid IUPAC Name: 2-carbamoyl-3-octylbenzoic acid Traditional Name: 2-carbamoyl-3-octyl-benzoic acid Formula: C16H23NO3 MolecularWeight: 277.35872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC(=C1C(=O)N)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CC=CC(=C1C(=O)N)C(=O)O

InChI

InChI=1S/C16H23NO3/c1-2-3-4-5-6-7-9-12-10-8-11-13(16(19)20)14(12)15(17)18/h8,10-11H,2-7,9H2,1H3,(H2,17,18)(H,19,20)