2-[(2,4-dimethylthiophen-3-yl)-(1-methoxypropan-2-yl)amino]-2-oxidanylidene-ethanesulfonic acid

Systemtic Name: 2-[(2,4-dimethylthiophen-3-yl)-(1-methoxypropan-2-yl)amino]-2-oxidanylidene-ethanesulfonic acid Openeye Name: 2-[(2,4-dimethyl-3-thienyl)-(2-methoxy-1-methyl-ethyl)amino]-2-oxo-ethanesulfonic acid CAS Name: 2-[(2,4-dimethyl-3-thiophenyl)-(1-methoxypropan-2-yl)amino]-2-oxoethanesulfonic acid IUPAC Name: 2-[(2,4-dimethylthiophen-3-yl)-(1-methoxypropan-2-yl)amino]-2-oxoethanesulfonic acid Traditional Name: 2-[(2,4-dimethyl-3-thienyl)-(2-methoxy-1-methyl-ethyl)amino]-2-keto-ethanesulfonic acid Formula: C12H19NO5S2 MolecularWeight: 321.41296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1N(C(C)COC)C(=O)CS(=O)(=O)O)C

Isomeric SMILES

CC1=CSC(=C1N(C(C)COC)C(=O)CS(=O)(=O)O)C

InChI

InChI=1S/C12H19NO5S2/c1-8-6-19-10(3)12(8)13(9(2)5-18-4)11(14)7-20(15,16)17/h6,9H,5,7H2,1-4H3,(H,15,16,17)