3-methyl-2-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrol-3-yl]butanoic acid

Systemtic Name: 3-methyl-2-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrol-3-yl]butanoic acid Openeye Name: 3-methyl-2-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrol-3-yl]butanoic acid CAS Name: 3-methyl-2-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-3-pyrrolyl]butanoic acid IUPAC Name: 3-methyl-2-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenylpyrrol-3-yl]butanoic acid Traditional Name: 2-[5-(4-mesylphenyl)-2-methyl-1-phenyl-pyrrol-3-yl]-3-methyl-butyric acid Formula: C23H25NO4S MolecularWeight: 411.5139

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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)C)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C23H25NO4S/c1-15(2)22(23(25)26)20-14-21(17-10-12-19(13-11-17)29(4,27)28)24(16(20)3)18-8-6-5-7-9-18/h5-15,22H,1-4H3,(H,25,26)