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

Systemtic Name: 3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propyl-diethyl-azanium Openeye Name: 3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-oxo-thiazolidin-3-yl]propyl-diethyl-ammonium CAS Name: 3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-oxo-3-thiazolidinyl]propyl-diethylammonium IUPAC Name: 3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-oxo-1,3-thiazolidin-3-yl]propyl-diethylazanium Traditional Name: 3-[(2S)-2-(1,3-benzodioxol-5-yl)-4-keto-thiazolidin-3-yl]propyl-diethyl-ammonium Formula: C17H25N2O3S+ MolecularWeight: 337.457

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O3S/c1-3-18(4-2)8-5-9-19-16(20)11-23-17(19)13-6-7-14-15(10-13)22-12-21-14/h6-7,10,17H,3-5,8-9,11-12H2,1-2H3/p+1/t17-/m0/s1