3-[2,5-bis(oxidanylidene)-3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)sulfanyl-pyrrolidin-1-yl]-4-methyl-benzoic acid

Systemtic Name: 3-[2,5-bis(oxidanylidene)-3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)sulfanyl-pyrrolidin-1-yl]-4-methyl-benzoic acid Openeye Name: 3-[3-(2-hydroxy-1-methyl-2-oxo-ethyl)sulfanyl-2,5-dioxo-pyrrolidin-1-yl]-4-methyl-benzoic acid CAS Name: 3-[3-[(1-hydroxy-1-oxopropan-2-yl)thio]-2,5-dioxo-1-pyrrolidinyl]-4-methylbenzoic acid IUPAC Name: 3-[3-(1-hydroxy-1-oxopropan-2-yl)sulfanyl-2,5-dioxopyrrolidin-1-yl]-4-methylbenzoic acid Traditional Name: 3-[3-[(2-hydroxy-2-keto-1-methyl-ethyl)thio]-2,5-diketo-pyrrolidino]-4-methyl-benzoic acid Formula: C15H15NO6S MolecularWeight: 337.3477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)N2C(=O)CC(C2=O)SC(C)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)N2C(=O)CC(C2=O)SC(C)C(=O)O

InChI

InChI=1S/C15H15NO6S/c1-7-3-4-9(15(21)22)5-10(7)16-12(17)6-11(13(16)18)23-8(2)14(19)20/h3-5,8,11H,6H2,1-2H3,(H,19,20)(H,21,22)