ethane-1,2-disulfonic acid; 4-(2-methylpropyl)-1,3-thiazole

Systemtic Name: ethane-1,2-disulfonic acid; 4-(2-methylpropyl)-1,3-thiazole Openeye Name: ethane-1,2-disulfonic acid; 4-isobutylthiazole CAS Name: ethane-1,2-disulfonic acid; 4-(2-methylpropyl)thiazole IUPAC Name: ethane-1,2-disulfonic acid; 4-(2-methylpropyl)-1,3-thiazole Traditional Name: ethane-1,2-disulfonic acid; 4-isobutylthiazole Formula: C9H17NO6S3 MolecularWeight: 331.42938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CSC=N1.C(CS(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC(C)CC1=CSC=N1.C(CS(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C7H11NS.C2H6O6S2/c1-6(2)3-7-4-9-5-8-7;3-9(4,5)1-2-10(6,7)8/h4-6H,3H2,1-2H3;1-2H2,(H,3,4,5)(H,6,7,8)