methyl 4-[2-(4-methylpent-3-enyl)-5-phenyl-phenyl]sulfanylbenzoate

Systemtic Name: methyl 4-[2-(4-methylpent-3-enyl)-5-phenyl-phenyl]sulfanylbenzoate Openeye Name: methyl 4-[2-(4-methylpent-3-enyl)-5-phenyl-phenyl]sulfanylbenzoate CAS Name: 4-[[2-(4-methylpent-3-enyl)-5-phenylphenyl]thio]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(4-methylpent-3-enyl)-5-phenylphenyl]sulfanylbenzoate Traditional Name: 4-[[2-(4-methylpent-3-enyl)-5-phenyl-phenyl]thio]benzoic acid methyl ester Formula: C26H26O2S MolecularWeight: 402.54844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC1=C(C=C(C=C1)C2=CC=CC=C2)SC3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC(=CCCC1=C(C=C(C=C1)C2=CC=CC=C2)SC3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C26H26O2S/c1-19(2)8-7-11-21-12-13-23(20-9-5-4-6-10-20)18-25(21)29-24-16-14-22(15-17-24)26(27)28-3/h4-6,8-10,12-18H,7,11H2,1-3H3