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

Systemtic Name: 2-[[(3R)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamoyl]benzoic acid Openeye Name: 2-[[(3R)-3-methyl-1,1-dioxo-thiolan-3-yl]carbamoyl]benzoic acid CAS Name: 2-[[[(3R)-3-methyl-1,1-dioxo-3-thiolanyl]amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[(3R)-3-methyl-1,1-dioxothiolan-3-yl]carbamoyl]benzoic acid Traditional Name: 2-[[(3R)-1,1-diketo-3-methyl-thiolan-3-yl]carbamoyl]benzoic acid Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

C[C@]1(CCS(=O)(=O)C1)NC(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C13H15NO5S/c1-13(6-7-20(18,19)8-13)14-11(15)9-4-2-3-5-10(9)12(16)17/h2-5H,6-8H2,1H3,(H,14,15)(H,16,17)/t13-/m1/s1