butyl 2-[1-(4-methoxyphenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]-2-oxidanylidene-ethanoate

Systemtic Name: butyl 2-[1-(4-methoxyphenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]-2-oxidanylidene-ethanoate Openeye Name: butyl 2-[1-(4-methoxyphenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]-2-oxo-acetate CAS Name: 2-[1-(4-methoxyphenyl)-2-methyl-5-(4-methylsulfonylphenyl)-3-pyrrolyl]-2-oxoacetic acid butyl ester IUPAC Name: butyl 2-[1-(4-methoxyphenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]-2-oxoacetate Traditional Name: 2-keto-2-[5-(4-mesylphenyl)-1-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]acetic acid butyl ester Formula: C25H27NO6S MolecularWeight: 469.54998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCCCOC(=O)C(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C25H27NO6S/c1-5-6-15-32-25(28)24(27)22-16-23(18-7-13-21(14-8-18)33(4,29)30)26(17(22)2)19-9-11-20(31-3)12-10-19/h7-14,16H,5-6,15H2,1-4H3