[(3R)-3-cyano-4-oxidanylidene-5-[2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoyloxy]pent-1-en-2-yl]azanium

Systemtic Name: [(3R)-3-cyano-4-oxidanylidene-5-[2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoyloxy]pent-1-en-2-yl]azanium Openeye Name: [(2R)-2-cyano-1-methylene-3-oxo-4-[2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetyl]oxy-butyl]ammonium CAS Name: [(3R)-3-cyano-4-oxo-5-[1-oxo-2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]ethoxy]pent-1-en-2-yl]ammonium IUPAC Name: [(3R)-3-cyano-4-oxo-5-[2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetyl]oxypent-1-en-2-yl]azanium Traditional Name: 1-[(1R)-1-cyano-2-keto-3-[2-[(2S)-3-keto-4H-1,4-benzothiazin-2-yl]acetyl]oxy-propyl]vinylammonium Formula: C16H16N3O4S+ MolecularWeight: 346.38094

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(C#N)C(=O)COC(=O)CC1C(=O)NC2=CC=CC=C2S1)[NH3+]

Isomeric SMILES

C=C([C@H](C#N)C(=O)COC(=O)C[C@H]1C(=O)NC2=CC=CC=C2S1)[NH3+]

InChI

InChI=1S/C16H15N3O4S/c1-9(18)10(7-17)12(20)8-23-15(21)6-14-16(22)19-11-4-2-3-5-13(11)24-14/h2-5,10,14H,1,6,8,18H2,(H,19,22)/p+1/t10-,14-/m0/s1