[(2S)-3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-2-oxidanyl-propyl]-diethyl-azanium

Systemtic Name: [(2S)-3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-2-oxidanyl-propyl]-diethyl-azanium Openeye Name: [(2S)-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-2-hydroxy-propyl]-diethyl-ammonium CAS Name: [(2S)-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-2-hydroxypropyl]-diethylammonium IUPAC Name: [(2S)-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-2-hydroxypropyl]-diethylazanium Traditional Name: [(2S)-3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-2-hydroxy-propyl]-diethyl-ammonium Formula: C14H22N3O3S+ MolecularWeight: 312.40778

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(CNC1=NS(=O)(=O)C2=CC=CC=C21)O

Isomeric SMILES

CC[NH+](CC)C[C@H](CNC1=NS(=O)(=O)C2=CC=CC=C21)O

InChI

InChI=1S/C14H21N3O3S/c1-3-17(4-2)10-11(18)9-15-14-12-7-5-6-8-13(12)21(19,20)16-14/h5-8,11,18H,3-4,9-10H2,1-2H3,(H,15,16)/p+1/t11-/m0/s1