(oxan-2-ylmethoxycarbonylamino) 4-methylbenzenesulfonate

Systemtic Name: (oxan-2-ylmethoxycarbonylamino) 4-methylbenzenesulfonate Openeye Name: (tetrahydropyran-2-ylmethoxycarbonylamino) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [[2-oxanylmethoxy(oxo)methyl]amino] ester IUPAC Name: (oxan-2-ylmethoxycarbonylamino) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (tetrahydropyran-2-ylmethoxycarbonylamino) ester Formula: C14H19NO6S MolecularWeight: 329.36876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ONC(=O)OCC2CCCCO2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ONC(=O)OCC2CCCCO2

InChI

InChI=1S/C14H19NO6S/c1-11-5-7-13(8-6-11)22(17,18)21-15-14(16)20-10-12-4-2-3-9-19-12/h5-8,12H,2-4,9-10H2,1H3,(H,15,16)