3-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)thiazolidine-4-carboxylic acid CAS Name: 3-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-oxomethyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-carbonyl)thiazolidine-4-carboxylic acid Formula: C13H12ClNO5S MolecularWeight: 329.75608

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)C(=O)N3CSCC3C(=O)O

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)C(=O)N3CSCC3C(=O)O

InChI

InChI=1S/C13H12ClNO5S/c14-8-3-7(4-10-11(8)20-2-1-19-10)12(16)15-6-21-5-9(15)13(17)18/h3-4,9H,1-2,5-6H2,(H,17,18)