4-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]carbonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]carbonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(1,1-dioxothiolane-3-carbonyl)amino]ethyl]benzoic acid CAS Name: 4-[2-[[(1,1-dioxo-3-thiolanyl)-oxomethyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-[(1,1-dioxothiolane-3-carbonyl)amino]ethyl]benzoic acid Traditional Name: 4-[2-[(1,1-diketothiolane-3-carbonyl)amino]ethyl]benzoic acid Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1C(=O)NCCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CS(=O)(=O)CC1C(=O)NCCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H17NO5S/c16-13(12-6-8-21(19,20)9-12)15-7-5-10-1-3-11(4-2-10)14(17)18/h1-4,12H,5-9H2,(H,15,16)(H,17,18)