2-(3-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)ethanoic acid

Systemtic Name: 2-(3-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)ethanoic acid Openeye Name: 2-(3-oxo-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)acetic acid CAS Name: 2-[3-oxo-6-(1-pyrrolidinylsulfonyl)-1,4-benzothiazin-4-yl]acetic acid IUPAC Name: 2-(3-oxo-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)acetic acid Traditional Name: 2-(3-keto-6-pyrrolidinosulfonyl-1,4-benzothiazin-4-yl)acetic acid Formula: C14H16N2O5S2 MolecularWeight: 356.41724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3CC(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3CC(=O)O

InChI

InChI=1S/C14H16N2O5S2/c17-13-9-22-12-4-3-10(7-11(12)16(13)8-14(18)19)23(20,21)15-5-1-2-6-15/h3-4,7H,1-2,5-6,8-9H2,(H,18,19)