(phenylmethyl) 2-phenylmethoxy-4-(phenylmethylsulfanyl)benzoate

Systemtic Name: (phenylmethyl) 2-phenylmethoxy-4-(phenylmethylsulfanyl)benzoate Openeye Name: benzyl 2-benzyloxy-4-benzylsulfanyl-benzoate CAS Name: 2-phenylmethoxy-4-(phenylmethylthio)benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-benzylsulfanyl-2-phenylmethoxybenzoate Traditional Name: 2-benzoxy-4-(benzylthio)benzoic acid benzyl ester Formula: C28H24O3S MolecularWeight: 440.55336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=CC(=C2)SCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=CC(=C2)SCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H24O3S/c29-28(31-20-23-12-6-2-7-13-23)26-17-16-25(32-21-24-14-8-3-9-15-24)18-27(26)30-19-22-10-4-1-5-11-22/h1-18H,19-21H2