methyl 3-(4-methylsulfonylphenyl)-4-phenyl-benzoate

Systemtic Name: methyl 3-(4-methylsulfonylphenyl)-4-phenyl-benzoate Openeye Name: methyl 3-(4-methylsulfonylphenyl)-4-phenyl-benzoate CAS Name: 3-(4-methylsulfonylphenyl)-4-phenylbenzoic acid methyl ester IUPAC Name: methyl 3-(4-methylsulfonylphenyl)-4-phenylbenzoate Traditional Name: 3-(4-mesylphenyl)-4-phenyl-benzoic acid methyl ester Formula: C21H18O4S MolecularWeight: 366.43022

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H18O4S/c1-25-21(22)17-10-13-19(15-6-4-3-5-7-15)20(14-17)16-8-11-18(12-9-16)26(2,23)24/h3-14H,1-2H3