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

Systemtic Name: 2-[(3S)-1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylethylazanium Openeye Name: 2-[(3S)-1-(4-methoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylethylammonium CAS Name: 2-[[(3S)-1-(4-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]ethylammonium IUPAC Name: 2-[(3S)-1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylethylazanium Traditional Name: 2-[[(3S)-2,5-diketo-1-(4-methoxyphenyl)pyrrolidin-3-yl]thio]ethylammonium Formula: C13H17N2O3S+ MolecularWeight: 281.35068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)CC(C2=O)SCC[NH3+]

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)SCC[NH3+]

InChI

InChI=1S/C13H16N2O3S/c1-18-10-4-2-9(3-5-10)15-12(16)8-11(13(15)17)19-7-6-14/h2-5,11H,6-8,14H2,1H3/p+1/t11-/m0/s1