3-(4-chlorophenyl)propyl 4-methylbenzenesulfonate

Systemtic Name: 3-(4-chlorophenyl)propyl 4-methylbenzenesulfonate Openeye Name: 3-(4-chlorophenyl)propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-(4-chlorophenyl)propyl ester IUPAC Name: 3-(4-chlorophenyl)propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(4-chlorophenyl)propyl ester Formula: C16H17ClO3S MolecularWeight: 324.82238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClO3S/c1-13-4-10-16(11-5-13)21(18,19)20-12-2-3-14-6-8-15(17)9-7-14/h4-11H,2-3,12H2,1H3