1-[2-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfanyl-2-methyl-pyrrolidin-1-yl]propan-1-one

Systemtic Name: 1-[2-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfanyl-2-methyl-pyrrolidin-1-yl]propan-1-one Openeye Name: 1-[2-(3,5-dichloro-4-hydroxy-phenyl)sulfanyl-2-methyl-pyrrolidin-1-yl]propan-1-one CAS Name: 1-[2-[(3,5-dichloro-4-hydroxyphenyl)thio]-2-methyl-1-pyrrolidinyl]-1-propanone IUPAC Name: 1-[2-(3,5-dichloro-4-hydroxyphenyl)sulfanyl-2-methylpyrrolidin-1-yl]propan-1-one Traditional Name: 1-[2-[(3,5-dichloro-4-hydroxy-phenyl)thio]-2-methyl-pyrrolidino]propan-1-one Formula: C14H17Cl2NO2S MolecularWeight: 334.26128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCCC1(C)SC2=CC(=C(C(=C2)Cl)O)Cl

Isomeric SMILES

CCC(=O)N1CCCC1(C)SC2=CC(=C(C(=C2)Cl)O)Cl

InChI

InChI=1S/C14H17Cl2NO2S/c1-3-12(18)17-6-4-5-14(17,2)20-9-7-10(15)13(19)11(16)8-9/h7-8,19H,3-6H2,1-2H3