(5-chloranyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-3-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-3-yl)methyl ester Formula: C16H15ClO5S MolecularWeight: 354.8053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC3=C(O2)C(=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC3=C(O2)C(=CC=C3)Cl

InChI

InChI=1S/C16H15ClO5S/c1-11-5-7-13(8-6-11)23(18,19)21-10-12-9-20-15-4-2-3-14(17)16(15)22-12/h2-8,12H,9-10H2,1H3