4-(16-sulfanylhexadecylamino)benzoic acid

Systemtic Name: 4-(16-sulfanylhexadecylamino)benzoic acid Openeye Name: 4-(16-sulfanylhexadecylamino)benzoic acid CAS Name: 4-(16-mercaptohexadecylamino)benzoic acid IUPAC Name: 4-(16-sulfanylhexadecylamino)benzoic acid Traditional Name: 4-(16-mercaptohexadecylamino)benzoic acid Formula: C23H39NO2S MolecularWeight: 393.62626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NCCCCCCCCCCCCCCCCS

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NCCCCCCCCCCCCCCCCS

InChI

InChI=1S/C23H39NO2S/c25-23(26)21-15-17-22(18-16-21)24-19-13-11-9-7-5-3-1-2-4-6-8-10-12-14-20-27/h15-18,24,27H,1-14,19-20H2,(H,25,26)