(6-azanylpyridin-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (6-azanylpyridin-2-yl) 4-methylbenzenesulfonate Openeye Name: (6-amino-2-pyridyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (6-amino-2-pyridinyl) ester IUPAC Name: (6-aminopyridin-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (6-amino-2-pyridyl) ester Formula: C12H12N2O3S MolecularWeight: 264.30028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=N2)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=N2)N

InChI

InChI=1S/C12H12N2O3S/c1-9-5-7-10(8-6-9)18(15,16)17-12-4-2-3-11(13)14-12/h2-8H,1H3,(H2,13,14)