1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-(4-methylsulfonylphenoxy)ethanone

Systemtic Name: 1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-(4-methylsulfonylphenoxy)ethanone Openeye Name: 1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-methylsulfonylphenoxy)ethanone CAS Name: 1-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-(4-methylsulfonylphenoxy)ethanone IUPAC Name: 1-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-(4-methylsulfonylphenoxy)ethanone Traditional Name: 1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-mesylphenoxy)ethanone Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)COC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)COC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C18H23NO4S/c1-12(2)19-13(3)10-17(14(19)4)18(20)11-23-15-6-8-16(9-7-15)24(5,21)22/h6-10,12H,11H2,1-5H3