2-methyl-1-[4-(2-methyl-1-oxidanyl-propyl)-1-(phenylsulfonyl)pyrrol-2-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-(2-methyl-1-oxidanyl-propyl)-1-(phenylsulfonyl)pyrrol-2-yl]propan-1-one Openeye Name: 1-[1-(benzenesulfonyl)-4-(1-hydroxy-2-methyl-propyl)pyrrol-2-yl]-2-methyl-propan-1-one CAS Name: 1-[1-(benzenesulfonyl)-4-(1-hydroxy-2-methylpropyl)-2-pyrrolyl]-2-methyl-1-propanone IUPAC Name: 1-[1-(benzenesulfonyl)-4-(1-hydroxy-2-methylpropyl)pyrrol-2-yl]-2-methylpropan-1-one Traditional Name: 1-[1-besyl-4-(1-hydroxy-2-methyl-propyl)pyrrol-2-yl]-2-methyl-propan-1-one Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO4S/c1-12(2)17(20)14-10-16(18(21)13(3)4)19(11-14)24(22,23)15-8-6-5-7-9-15/h5-13,17,20H,1-4H3