[3-chloranyl-2,2-bis(chloromethyl)propyl] 4-methylbenzenesulfonate

Systemtic Name: [3-chloranyl-2,2-bis(chloromethyl)propyl] 4-methylbenzenesulfonate Openeye Name: [3-chloro-2,2-bis(chloromethyl)propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-chloro-2,2-bis(chloromethyl)propyl] ester IUPAC Name: [3-chloro-2,2-bis(chloromethyl)propyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-chloro-2,2-bis(chloromethyl)propyl] ester Formula: C12H15Cl3O3S MolecularWeight: 345.6697

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(CCl)(CCl)CCl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(CCl)(CCl)CCl

InChI

InChI=1S/C12H15Cl3O3S/c1-10-2-4-11(5-3-10)19(16,17)18-9-12(6-13,7-14)8-15/h2-5H,6-9H2,1H3