(5-morpholin-4-ylcarbonylpyridin-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (5-morpholin-4-ylcarbonylpyridin-2-yl) 4-methylbenzenesulfonate Openeye Name: [5-(morpholine-4-carbonyl)-2-pyridyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-[4-morpholinyl(oxo)methyl]-2-pyridinyl] ester IUPAC Name: [5-(morpholine-4-carbonyl)pyridin-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [5-(morpholine-4-carbonyl)-2-pyridyl] ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=NC=C(C=C2)C(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=NC=C(C=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C17H18N2O5S/c1-13-2-5-15(6-3-13)25(21,22)24-16-7-4-14(12-18-16)17(20)19-8-10-23-11-9-19/h2-7,12H,8-11H2,1H3