2-[(3S)-2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]sulfanylethanoate

Systemtic Name: 2-[(3S)-2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]sulfanylethanoate Openeye Name: 2-[(3S)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]sulfanylacetate CAS Name: 2-[[(3S)-2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]thio]acetate IUPAC Name: 2-[(3S)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]sulfanylacetate Traditional Name: 2-[[(3S)-2,5-diketo-1-(4-propoxyphenyl)pyrrolidin-3-yl]thio]acetate Formula: C15H16NO5S- MolecularWeight: 322.35624

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SCC(=O)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)SCC(=O)[O-]

InChI

InChI=1S/C15H17NO5S/c1-2-7-21-11-5-3-10(4-6-11)16-13(17)8-12(15(16)20)22-9-14(18)19/h3-6,12H,2,7-9H2,1H3,(H,18,19)/p-1/t12-/m0/s1