(2-oxidanylidene-1,3-diazinan-5-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-oxidanylidene-1,3-diazinan-5-yl) 4-methylbenzenesulfonate Openeye Name: (2-oxohexahydropyrimidin-5-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-oxo-1,3-diazinan-5-yl) ester IUPAC Name: (2-oxo-1,3-diazinan-5-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-ketohexahydropyrimidin-5-yl) ester Formula: C11H14N2O4S MolecularWeight: 270.30486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CNC(=O)NC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CNC(=O)NC2

InChI

InChI=1S/C11H14N2O4S/c1-8-2-4-10(5-3-8)18(15,16)17-9-6-12-11(14)13-7-9/h2-5,9H,6-7H2,1H3,(H2,12,13,14)