[(2R)-7-oxidanyl-3,4-dihydro-2H-chromen-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(2R)-7-oxidanyl-3,4-dihydro-2H-chromen-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(2R)-7-hydroxychroman-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R)-7-hydroxy-3,4-dihydro-2H-1-benzopyran-2-yl]methyl ester IUPAC Name: [(2R)-7-hydroxy-3,4-dihydro-2H-chromen-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R)-7-hydroxychroman-2-yl]methyl ester Formula: C17H18O5S MolecularWeight: 334.38682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCC3=C(O2)C=C(C=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2CCC3=C(O2)C=C(C=C3)O

InChI

InChI=1S/C17H18O5S/c1-12-2-8-16(9-3-12)23(19,20)21-11-15-7-5-13-4-6-14(18)10-17(13)22-15/h2-4,6,8-10,15,18H,5,7,11H2,1H3/t15-/m1/s1