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4-[3-[5-(methylsulfanylmethyl)-2-phenylmethoxy-phenyl]propyl]benzoate

4-[3-[5-(methylsulfanylmethyl)-2-phenylmethoxy-phenyl]propyl]benzoate

Systemtic Name:4-[3-[5-(methylsulfanylmethyl)-2-phenylmethoxy-phenyl]propyl]benzoate
Openeye Name:4-[3-[2-benzyloxy-5-(methylsulfanylmethyl)phenyl]propyl]benzoate
CAS Name:4-[3-[5-[(methylthio)methyl]-2-phenylmethoxyphenyl]propyl]benzoate
IUPAC Name:4-[3-[5-(methylsulfanylmethyl)-2-phenylmethoxyphenyl]propyl]benzoate
Traditional Name:4-[3-[2-benzoxy-5-[(methylthio)methyl]phenyl]propyl]benzoate
Formula: C25H25O3S-
MolecularWeight: 405.5292
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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC(=C(C=C1)OCC2=CC=CC=C2)CCCC3=CC=C(C=C3)C(=O)[O-]


Isomeric SMILES

CSCC1=CC(=C(C=C1)OCC2=CC=CC=C2)CCCC3=CC=C(C=C3)C(=O)[O-]


InChI

InChI=1S/C25H26O3S/c1-29-18-21-12-15-24(28-17-20-6-3-2-4-7-20)23(16-21)9-5-8-19-10-13-22(14-11-19)25(26)27/h2-4,6-7,10-16H,5,8-9,17-18H2,1H3,(H,26,27)/p-1


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