diethyl (3R,4S)-3-(1-bromanyl-2-methoxy-2-oxidanylidene-ethyl)-4-[(4-methylphenyl)sulfonylmethyl]cyclopentane-1,1-dicarboxylate

Systemtic Name: diethyl (3R,4S)-3-(1-bromanyl-2-methoxy-2-oxidanylidene-ethyl)-4-[(4-methylphenyl)sulfonylmethyl]cyclopentane-1,1-dicarboxylate Openeye Name: diethyl (3R,4S)-3-(1-bromo-2-methoxy-2-oxo-ethyl)-4-(p-tolylsulfonylmethyl)cyclopentane-1,1-dicarboxylate CAS Name: (3R,4S)-3-(1-bromo-2-methoxy-2-oxoethyl)-4-[(4-methylphenyl)sulfonylmethyl]cyclopentane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl (3R,4S)-3-(1-bromo-2-methoxy-2-oxoethyl)-4-[(4-methylphenyl)sulfonylmethyl]cyclopentane-1,1-dicarboxylate Traditional Name: (3R,4S)-3-(1-bromo-2-keto-2-methoxy-ethyl)-4-(tosylmethyl)cyclopentane-1,1-dicarboxylic acid diethyl ester Formula: C22H29BrO8S MolecularWeight: 533.42986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(C(C1)C(C(=O)OC)Br)CS(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C22H29BrO8S/c1-5-30-20(25)22(21(26)31-6-2)11-15(17(12-22)18(23)19(24)29-4)13-32(27,28)16-9-7-14(3)8-10-16/h7-10,15,17-18H,5-6,11-13H2,1-4H3/t15-,17-,18?/m1/s1