2-(4-carboxyoctanoylamino)benzoic acid

Systemtic Name: 2-(4-carboxyoctanoylamino)benzoic acid Openeye Name: 2-(4-carboxyoctanoylamino)benzoic acid CAS Name: 2-[(4-carboxy-1-oxooctyl)amino]benzoic acid IUPAC Name: 2-(4-carboxyoctanoylamino)benzoic acid Traditional Name: 2-(4-carboxyoctanoylamino)benzoic acid Formula: C16H21NO5 MolecularWeight: 307.34164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC(=O)NC1=CC=CC=C1C(=O)O)C(=O)O

Isomeric SMILES

CCCCC(CCC(=O)NC1=CC=CC=C1C(=O)O)C(=O)O

InChI

InChI=1S/C16H21NO5/c1-2-3-6-11(15(19)20)9-10-14(18)17-13-8-5-4-7-12(13)16(21)22/h4-5,7-8,11H,2-3,6,9-10H2,1H3,(H,17,18)(H,19,20)(H,21,22)