2-[5-methoxy-6-methyl-4-(2-sulfoethyl)pyridin-3-yl]ethanesulfonic acid

Systemtic Name: 2-[5-methoxy-6-methyl-4-(2-sulfoethyl)pyridin-3-yl]ethanesulfonic acid Openeye Name: 2-[5-methoxy-6-methyl-4-(2-sulfoethyl)-3-pyridyl]ethanesulfonic acid CAS Name: 2-[5-methoxy-6-methyl-4-(2-sulfoethyl)-3-pyridinyl]ethanesulfonic acid IUPAC Name: 2-[5-methoxy-6-methyl-4-(2-sulfoethyl)pyridin-3-yl]ethanesulfonic acid Traditional Name: 2-[5-methoxy-6-methyl-4-(2-sulfoethyl)-3-pyridyl]ethanesulfonic acid Formula: C11H17NO7S2 MolecularWeight: 339.38518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1OC)CCS(=O)(=O)O)CCS(=O)(=O)O

Isomeric SMILES

CC1=NC=C(C(=C1OC)CCS(=O)(=O)O)CCS(=O)(=O)O

InChI

InChI=1S/C11H17NO7S2/c1-8-11(19-2)10(4-6-21(16,17)18)9(7-12-8)3-5-20(13,14)15/h7H,3-6H2,1-2H3,(H,13,14,15)(H,16,17,18)