3-[1-(4-chloranyl-2-methyl-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpropanoic acid

Systemtic Name: 3-[1-(4-chloranyl-2-methyl-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpropanoic acid Openeye Name: 3-[1-(4-chloro-2-methyl-phenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylpropanoic acid CAS Name: 3-[[1-(4-chloro-2-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]propanoic acid IUPAC Name: 3-[1-(4-chloro-2-methylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpropanoic acid Traditional Name: 3-[[1-(4-chloro-2-methyl-phenyl)-2,5-diketo-pyrrolidin-3-yl]thio]propionic acid Formula: C14H14ClNO4S MolecularWeight: 327.78326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)N2C(=O)CC(C2=O)SCCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)N2C(=O)CC(C2=O)SCCC(=O)O

InChI

InChI=1S/C14H14ClNO4S/c1-8-6-9(15)2-3-10(8)16-12(17)7-11(14(16)20)21-5-4-13(18)19/h2-3,6,11H,4-5,7H2,1H3,(H,18,19)