3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propyl-dimethyl-azanium Openeye Name: 3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-oxo-thiazolidin-3-yl]propyl-dimethyl-ammonium CAS Name: 3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-oxo-3-thiazolidinyl]propyl-dimethylammonium IUPAC Name: 3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-oxo-1,3-thiazolidin-3-yl]propyl-dimethylazanium Traditional Name: 3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-keto-thiazolidin-3-yl]propyl-dimethyl-ammonium Formula: C15H21N2O3S+ MolecularWeight: 309.40384

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C(SCC1=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[NH+](C)CCCN1[C@@H](SCC1=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H20N2O3S/c1-16(2)6-3-7-17-14(18)9-21-15(17)11-4-5-12-13(8-11)20-10-19-12/h4-5,8,15H,3,6-7,9-10H2,1-2H3/p+1/t15-/m0/s1