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

Systemtic Name: 2-[(3S)-2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]sulfanylethylazanium Openeye Name: 2-[(3S)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]sulfanylethylammonium CAS Name: 2-[[(3S)-2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]thio]ethylammonium IUPAC Name: 2-[(3S)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]sulfanylethylazanium Traditional Name: 2-[[(3S)-2,5-diketo-1-(4-propoxyphenyl)pyrrolidin-3-yl]thio]ethylammonium Formula: C15H21N2O3S+ MolecularWeight: 309.40384

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SCC[NH3+]

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)SCC[NH3+]

InChI

InChI=1S/C15H20N2O3S/c1-2-8-20-12-5-3-11(4-6-12)17-14(18)10-13(15(17)19)21-9-7-16/h3-6,13H,2,7-10,16H2,1H3/p+1/t13-/m0/s1