4-(2,3-dihydro-1H-inden-5-ylsulfonylmethyl)-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-(2,3-dihydro-1H-inden-5-ylsulfonylmethyl)-1,3-thiazole-2-carboxylic acid Openeye Name: 4-(indan-5-ylsulfonylmethyl)thiazole-2-carboxylic acid CAS Name: 4-(2,3-dihydro-1H-inden-5-ylsulfonylmethyl)-2-thiazolecarboxylic acid IUPAC Name: 4-(2,3-dihydro-1H-inden-5-ylsulfonylmethyl)-1,3-thiazole-2-carboxylic acid Traditional Name: 4-(indan-5-ylsulfonylmethyl)thiazole-2-carboxylic acid Formula: C14H13NO4S2 MolecularWeight: 323.38732

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)CC3=CSC(=N3)C(=O)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)CC3=CSC(=N3)C(=O)O

InChI

InChI=1S/C14H13NO4S2/c16-14(17)13-15-11(7-20-13)8-21(18,19)12-5-4-9-2-1-3-10(9)6-12/h4-7H,1-3,8H2,(H,16,17)