2-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]ethanoyl-methyl-amino]benzoic acid

Systemtic Name: 2-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]ethanoyl-methyl-amino]benzoic acid Openeye Name: 2-[[2-(1,1-dioxothiolan-3-yl)acetyl]-methyl-amino]benzoic acid CAS Name: 2-[[2-(1,1-dioxo-3-thiolanyl)-1-oxoethyl]-methylamino]benzoic acid IUPAC Name: 2-[[2-(1,1-dioxothiolan-3-yl)acetyl]-methylamino]benzoic acid Traditional Name: 2-[[2-(1,1-diketothiolan-3-yl)acetyl]-methyl-amino]benzoic acid Formula: C14H17NO5S MolecularWeight: 311.35348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)O)C(=O)CC2CCS(=O)(=O)C2

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)O)C(=O)CC2CCS(=O)(=O)C2

InChI

InChI=1S/C14H17NO5S/c1-15(12-5-3-2-4-11(12)14(17)18)13(16)8-10-6-7-21(19,20)9-10/h2-5,10H,6-9H2,1H3,(H,17,18)