4-(11-sulfanylundecylamino)benzoic acid

Systemtic Name: 4-(11-sulfanylundecylamino)benzoic acid Openeye Name: 4-(11-sulfanylundecylamino)benzoic acid CAS Name: 4-(11-mercaptoundecylamino)benzoic acid IUPAC Name: 4-(11-sulfanylundecylamino)benzoic acid Traditional Name: 4-(11-mercaptoundecylamino)benzoic acid Formula: C18H29NO2S MolecularWeight: 323.49336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NCCCCCCCCCCCS

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NCCCCCCCCCCCS

InChI

InChI=1S/C18H29NO2S/c20-18(21)16-10-12-17(13-11-16)19-14-8-6-4-2-1-3-5-7-9-15-22/h10-13,19,22H,1-9,14-15H2,(H,20,21)