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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC1=C(C=C(C=C1)C(=O)OC)OC)(C(=O)OC2=CC=CC(=C2)CCCCCCCCC3=CC=CC=C3)O

Isomeric SMILES

CC(CSCC1=C(C=C(C=C1)C(=O)OC)OC)(C(=O)OC2=CC=CC(=C2)CCCCCCCCC3=CC=CC=C3)O

InChI

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