methyl 3-methoxy-4-[[3-methoxy-2-oxidanyl-3-oxidanylidene-1-[2-(8-phenyloctyl)phenyl]propyl]sulfanylmethyl]benzoate

Systemtic Name: methyl 3-methoxy-4-[[3-methoxy-2-oxidanyl-3-oxidanylidene-1-[2-(8-phenyloctyl)phenyl]propyl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[[2-hydroxy-3-methoxy-3-oxo-1-[2-(8-phenyloctyl)phenyl]propyl]sulfanylmethyl]-3-methoxy-benzoate CAS Name: 4-[[[2-hydroxy-3-methoxy-3-oxo-1-[2-(8-phenyloctyl)phenyl]propyl]thio]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[2-hydroxy-3-methoxy-3-oxo-1-[2-(8-phenyloctyl)phenyl]propyl]sulfanylmethyl]-3-methoxybenzoate Traditional Name: 4-[[[2-hydroxy-3-keto-3-methoxy-1-[2-(8-phenyloctyl)phenyl]propyl]thio]methyl]-3-methoxy-benzoic acid methyl ester Formula: C34H42O6S MolecularWeight: 578.75868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)CSC(C2=CC=CC=C2CCCCCCCCC3=CC=CC=C3)C(C(=O)OC)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)CSC(C2=CC=CC=C2CCCCCCCCC3=CC=CC=C3)C(C(=O)OC)O

InChI

InChI=1S/C34H42O6S/c1-38-30-23-27(33(36)39-2)21-22-28(30)24-41-32(31(35)34(37)40-3)29-20-14-13-19-26(29)18-12-7-5-4-6-9-15-25-16-10-8-11-17-25/h8,10-11,13-14,16-17,19-23,31-32,35H,4-7,9,12,15,18,24H2,1-3H3