2-oxidanyl-5-[[5-[(phenylmethylsulfanyl)methyl]furan-2-yl]carbonylamino]benzoic acid

Systemtic Name: 2-oxidanyl-5-[[5-[(phenylmethylsulfanyl)methyl]furan-2-yl]carbonylamino]benzoic acid Openeye Name: 5-[[5-(benzylsulfanylmethyl)furan-2-carbonyl]amino]-2-hydroxy-benzoic acid CAS Name: 2-hydroxy-5-[[oxo-[5-[(phenylmethylthio)methyl]-2-furanyl]methyl]amino]benzoic acid IUPAC Name: 5-[[5-(benzylsulfanylmethyl)furan-2-carbonyl]amino]-2-hydroxybenzoic acid Traditional Name: 5-[[5-[(benzylthio)methyl]-2-furoyl]amino]-2-hydroxy-benzoic acid Formula: C20H17NO5S MolecularWeight: 383.41768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=CC=C(O2)C(=O)NC3=CC(=C(C=C3)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=CC=C(O2)C(=O)NC3=CC(=C(C=C3)O)C(=O)O

InChI

InChI=1S/C20H17NO5S/c22-17-8-6-14(10-16(17)20(24)25)21-19(23)18-9-7-15(26-18)12-27-11-13-4-2-1-3-5-13/h1-10,22H,11-12H2,(H,21,23)(H,24,25)