2-[(6-but-2-ynoxypyridin-3-yl)sulfonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(6-but-2-ynoxypyridin-3-yl)sulfonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(6-but-2-ynoxy-3-pyridyl)sulfonyl-methyl-amino]acetic acid CAS Name: 2-[(6-but-2-ynoxy-3-pyridinyl)sulfonyl-methylamino]acetic acid IUPAC Name: 2-[(6-but-2-ynoxypyridin-3-yl)sulfonyl-methylamino]acetic acid Traditional Name: 2-[(6-but-2-ynoxy-3-pyridyl)sulfonyl-methyl-amino]acetic acid Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=NC=C(C=C1)S(=O)(=O)N(C)CC(=O)O

Isomeric SMILES

CC#CCOC1=NC=C(C=C1)S(=O)(=O)N(C)CC(=O)O

InChI

InChI=1S/C12H14N2O5S/c1-3-4-7-19-11-6-5-10(8-13-11)20(17,18)14(2)9-12(15)16/h5-6,8H,7,9H2,1-2H3,(H,15,16)