3-(4-chloranylphenoxy)propyl 4-methylbenzenesulfonate

Systemtic Name: 3-(4-chloranylphenoxy)propyl 4-methylbenzenesulfonate Openeye Name: 3-(4-chlorophenoxy)propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-(4-chlorophenoxy)propyl ester IUPAC Name: 3-(4-chlorophenoxy)propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(4-chlorophenoxy)propyl ester Formula: C16H17ClO4S MolecularWeight: 340.82178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClO4S/c1-13-3-9-16(10-4-13)22(18,19)21-12-2-11-20-15-7-5-14(17)6-8-15/h3-10H,2,11-12H2,1H3