1-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-oxo-4H-1,4-benzothiazine-6-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-oxo-4H-1,4-benzothiazine-6-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(3-keto-4H-1,4-benzothiazine-6-carbonyl)proline Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC3=C(C=C2)SCC(=O)N3)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC3=C(C=C2)SCC(=O)N3)C(=O)O

InChI

InChI=1S/C14H14N2O4S/c17-12-7-21-11-4-3-8(6-9(11)15-12)13(18)16-5-1-2-10(16)14(19)20/h3-4,6,10H,1-2,5,7H2,(H,15,17)(H,19,20)