3-(3-phenylmethoxyphenyl)butyl 4-methylbenzenesulfonate

Systemtic Name: 3-(3-phenylmethoxyphenyl)butyl 4-methylbenzenesulfonate Openeye Name: 3-(3-benzyloxyphenyl)butyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-(3-phenylmethoxyphenyl)butyl ester IUPAC Name: 3-(3-phenylmethoxyphenyl)butyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(3-benzoxyphenyl)butyl ester Formula: C24H26O4S MolecularWeight: 410.52584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)C2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C24H26O4S/c1-19-11-13-24(14-12-19)29(25,26)28-16-15-20(2)22-9-6-10-23(17-22)27-18-21-7-4-3-5-8-21/h3-14,17,20H,15-16,18H2,1-2H3