methyl (1S,4R)-3,3-diethyl-4-(iodanylmethyl)-1-(phenylsulfonyl)cyclopentane-1-carboxylate

Systemtic Name: methyl (1S,4R)-3,3-diethyl-4-(iodanylmethyl)-1-(phenylsulfonyl)cyclopentane-1-carboxylate Openeye Name: methyl (1S,4R)-1-(benzenesulfonyl)-3,3-diethyl-4-(iodomethyl)cyclopentanecarboxylate CAS Name: (1S,4R)-1-(benzenesulfonyl)-3,3-diethyl-4-(iodomethyl)-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl (1S,4R)-1-(benzenesulfonyl)-3,3-diethyl-4-(iodomethyl)cyclopentane-1-carboxylate Traditional Name: (1S,4R)-1-besyl-3,3-diethyl-4-(iodomethyl)cyclopentanecarboxylic acid methyl ester Formula: C18H25IO4S MolecularWeight: 464.35817

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CC1CI)(C(=O)OC)S(=O)(=O)C2=CC=CC=C2)CC

Isomeric SMILES

CCC1(C[C@@](C[C@H]1CI)(C(=O)OC)S(=O)(=O)C2=CC=CC=C2)CC

InChI

InChI=1S/C18H25IO4S/c1-4-17(5-2)13-18(16(20)23-3,11-14(17)12-19)24(21,22)15-9-7-6-8-10-15/h6-10,14H,4-5,11-13H2,1-3H3/t14-,18-/m0/s1