2-[2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanoylamino]benzoic acid

Systemtic Name: 2-[2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]ethanoylamino]benzoic acid Openeye Name: 2-[[2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]acetyl]amino]benzoic acid CAS Name: 2-[[2-[(5-acetyl-2-methoxyphenyl)methylthio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]acetyl]amino]benzoic acid Traditional Name: 2-[[2-[(5-acetyl-2-methoxy-benzyl)thio]acetyl]amino]benzoic acid Formula: C19H19NO5S MolecularWeight: 373.42286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSCC(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C19H19NO5S/c1-12(21)13-7-8-17(25-2)14(9-13)10-26-11-18(22)20-16-6-4-3-5-15(16)19(23)24/h3-9H,10-11H2,1-2H3,(H,20,22)(H,23,24)