(4-methylsulfanylphenyl)methyl 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid [4-(methylthio)benzyl] ester Formula: C22H18O3S MolecularWeight: 362.44152

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

CSC1=CC=C(C=C1)COC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C22H18O3S/c1-26-18-9-6-15(7-10-18)13-25-21(23)12-17-14-24-20-11-8-16-4-2-3-5-19(16)22(17)20/h2-11,14H,12-13H2,1H3