methyl 2-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrol-3-yl]-2-oxidanyl-propanoate

Systemtic Name: methyl 2-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrol-3-yl]-2-oxidanyl-propanoate Openeye Name: methyl 2-hydroxy-2-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrol-3-yl]propanoate CAS Name: 2-hydroxy-2-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-3-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 2-hydroxy-2-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenylpyrrol-3-yl]propanoate Traditional Name: 2-hydroxy-2-[5-(4-mesylphenyl)-2-methyl-1-phenyl-pyrrol-3-yl]propionic acid methyl ester Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C(C)(C(=O)OC)O

Isomeric SMILES

CC1=C(C=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C(C)(C(=O)OC)O

InChI

InChI=1S/C22H23NO5S/c1-15-19(22(2,25)21(24)28-3)14-20(23(15)17-8-6-5-7-9-17)16-10-12-18(13-11-16)29(4,26)27/h5-14,25H,1-4H3