trimethyl-[3-[2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoylamino]propyl]azanium

Systemtic Name: trimethyl-[3-[2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoylamino]propyl]azanium Openeye Name: trimethyl-[3-[[2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetyl]amino]propyl]ammonium CAS Name: trimethyl-[3-[[1-oxo-2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]ethyl]amino]propyl]ammonium IUPAC Name: trimethyl-[3-[[2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetyl]amino]propyl]azanium Traditional Name: 3-[[2-[(2S)-3-keto-4H-1,4-benzothiazin-2-yl]acetyl]amino]propyl-trimethyl-ammonium Formula: C16H24N3O2S+ MolecularWeight: 322.44566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCNC(=O)CC1C(=O)NC2=CC=CC=C2S1

Isomeric SMILES

C[N+](C)(C)CCCNC(=O)C[C@H]1C(=O)NC2=CC=CC=C2S1

InChI

InChI=1S/C16H23N3O2S/c1-19(2,3)10-6-9-17-15(20)11-14-16(21)18-12-7-4-5-8-13(12)22-14/h4-5,7-8,14H,6,9-11H2,1-3H3,(H-,17,18,20,21)/p+1/t14-/m0/s1