diethyl (3S,4R)-3-(chloromethyl)-4-(phenylsulfonylmethyl)cyclopentane-1,1-dicarboxylate

Systemtic Name: diethyl (3S,4R)-3-(chloromethyl)-4-(phenylsulfonylmethyl)cyclopentane-1,1-dicarboxylate Openeye Name: diethyl (3R,4S)-3-(benzenesulfonylmethyl)-4-(chloromethyl)cyclopentane-1,1-dicarboxylate CAS Name: (3R,4S)-3-(benzenesulfonylmethyl)-4-(chloromethyl)cyclopentane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl (3R,4S)-3-(benzenesulfonylmethyl)-4-(chloromethyl)cyclopentane-1,1-dicarboxylate Traditional Name: (3R,4S)-3-(besylmethyl)-4-(chloromethyl)cyclopentane-1,1-dicarboxylic acid diethyl ester Formula: C19H25ClO6S MolecularWeight: 416.9162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(C(C1)CCl)CS(=O)(=O)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(C[C@H]([C@H](C1)CCl)CS(=O)(=O)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C19H25ClO6S/c1-3-25-17(21)19(18(22)26-4-2)10-14(12-20)15(11-19)13-27(23,24)16-8-6-5-7-9-16/h5-9,14-15H,3-4,10-13H2,1-2H3/t14-,15+/m1/s1