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

Systemtic Name: 3-[(3R)-1-(4-chloranyl-2-methyl-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpropanoate Openeye Name: 3-[(3R)-1-(4-chloro-2-methyl-phenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylpropanoate CAS Name: 3-[[(3R)-1-(4-chloro-2-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]propanoate IUPAC Name: 3-[(3R)-1-(4-chloro-2-methylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpropanoate Traditional Name: 3-[[(3R)-1-(4-chloro-2-methyl-phenyl)-2,5-diketo-pyrrolidin-3-yl]thio]propionate Formula: C14H13ClNO4S- MolecularWeight: 326.77532

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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)C[C@H](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)/p-1/t11-/m1/s1