[3-(5-methyl-2-phenylmethoxy-phenyl)-3-phenyl-propyl] 4-methylbenzenesulfonate

Systemtic Name: [3-(5-methyl-2-phenylmethoxy-phenyl)-3-phenyl-propyl] 4-methylbenzenesulfonate Openeye Name: [3-(2-benzyloxy-5-methyl-phenyl)-3-phenyl-propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(5-methyl-2-phenylmethoxyphenyl)-3-phenylpropyl] ester IUPAC Name: [3-(5-methyl-2-phenylmethoxyphenyl)-3-phenylpropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-(2-benzoxy-5-methyl-phenyl)-3-phenyl-propyl] ester Formula: C30H30O4S MolecularWeight: 486.6218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C2=CC=CC=C2)C3=C(C=CC(=C3)C)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C2=CC=CC=C2)C3=C(C=CC(=C3)C)OCC4=CC=CC=C4

InChI

InChI=1S/C30H30O4S/c1-23-13-16-27(17-14-23)35(31,32)34-20-19-28(26-11-7-4-8-12-26)29-21-24(2)15-18-30(29)33-22-25-9-5-3-6-10-25/h3-18,21,28H,19-20,22H2,1-2H3