3-(5,5-dimethyloxolan-2-yl)-1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]propan-1-one

Systemtic Name: 3-(5,5-dimethyloxolan-2-yl)-1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]propan-1-one Openeye Name: 3-(5,5-dimethyltetrahydrofuran-2-yl)-1-[1-(p-tolylsulfonyl)pyrrol-3-yl]propan-1-one CAS Name: 3-(5,5-dimethyl-2-oxolanyl)-1-[1-(4-methylphenyl)sulfonyl-3-pyrrolyl]-1-propanone IUPAC Name: 3-(5,5-dimethyloxolan-2-yl)-1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]propan-1-one Traditional Name: 3-(5,5-dimethyltetrahydrofuran-2-yl)-1-(1-tosylpyrrol-3-yl)propan-1-one Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)CCC3CCC(O3)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)CCC3CCC(O3)(C)C

InChI

InChI=1S/C20H25NO4S/c1-15-4-7-18(8-5-15)26(23,24)21-13-11-16(14-21)19(22)9-6-17-10-12-20(2,3)25-17/h4-5,7-8,11,13-14,17H,6,9-10,12H2,1-3H3