2-[(octyldisulfanyl)carbonylamino]-6-oxidanyl-benzoic acid

Systemtic Name: 2-[(octyldisulfanyl)carbonylamino]-6-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-6-[(octyldisulfanyl)carbonylamino]benzoic acid CAS Name: 2-hydroxy-6-[[(octyldisulfanyl)-oxomethyl]amino]benzoic acid IUPAC Name: 2-hydroxy-6-[(octyldisulfanyl)carbonylamino]benzoic acid Traditional Name: 2-hydroxy-6-[(octyldisulfanyl)carbonylamino]benzoic acid Formula: C16H23NO4S2 MolecularWeight: 357.48812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSSC(=O)NC1=C(C(=CC=C1)O)C(=O)O

Isomeric SMILES

CCCCCCCCSSC(=O)NC1=C(C(=CC=C1)O)C(=O)O

InChI

InChI=1S/C16H23NO4S2/c1-2-3-4-5-6-7-11-22-23-16(21)17-12-9-8-10-13(18)14(12)15(19)20/h8-10,18H,2-7,11H2,1H3,(H,17,21)(H,19,20)