[(1S)-2-azanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-sulfanylidene-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-azanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-sulfanylidene-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thioxo-ethyl]-diethyl-ammonium CAS Name: [(1S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-sulfanylideneethyl]-diethylammonium IUPAC Name: [(1S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-sulfanylideneethyl]-diethylazanium Traditional Name: [(1S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thioxo-ethyl]-diethyl-ammonium Formula: C14H21N2O2S+ MolecularWeight: 281.39374

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C1=CC2=C(C=C1)OCCO2)C(=S)N

Isomeric SMILES

CC[NH+](CC)[C@@H](C1=CC2=C(C=C1)OCCO2)C(=S)N

InChI

InChI=1S/C14H20N2O2S/c1-3-16(4-2)13(14(15)19)10-5-6-11-12(9-10)18-8-7-17-11/h5-6,9,13H,3-4,7-8H2,1-2H3,(H2,15,19)/p+1/t13-/m0/s1