4,4-dimethoxy-3-methyl-1-[1-(phenylsulfonyl)pyrrol-3-yl]butan-1-one

Systemtic Name: 4,4-dimethoxy-3-methyl-1-[1-(phenylsulfonyl)pyrrol-3-yl]butan-1-one Openeye Name: 1-[1-(benzenesulfonyl)pyrrol-3-yl]-4,4-dimethoxy-3-methyl-butan-1-one CAS Name: 1-[1-(benzenesulfonyl)-3-pyrrolyl]-4,4-dimethoxy-3-methyl-1-butanone IUPAC Name: 1-[1-(benzenesulfonyl)pyrrol-3-yl]-4,4-dimethoxy-3-methylbutan-1-one Traditional Name: 1-(1-besylpyrrol-3-yl)-4,4-dimethoxy-3-methyl-butan-1-one Formula: C17H21NO5S MolecularWeight: 351.41734

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CN(C=C1)S(=O)(=O)C2=CC=CC=C2)C(OC)OC

Isomeric SMILES

CC(CC(=O)C1=CN(C=C1)S(=O)(=O)C2=CC=CC=C2)C(OC)OC

InChI

InChI=1S/C17H21NO5S/c1-13(17(22-2)23-3)11-16(19)14-9-10-18(12-14)24(20,21)15-7-5-4-6-8-15/h4-10,12-13,17H,11H2,1-3H3