[(1S)-2,2-bis(chloranyl)cyclopropyl]methyl 4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzoate

Systemtic Name: [(1S)-2,2-bis(chloranyl)cyclopropyl]methyl 4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzoate Openeye Name: [(1S)-2,2-dichlorocyclopropyl]methyl 4-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]benzoic acid [(1S)-2,2-dichlorocyclopropyl]methyl ester IUPAC Name: [(1S)-2,2-dichlorocyclopropyl]methyl 4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[(3R,5R)-3,5-dimethylpiperidino]sulfonylbenzoic acid [(1S)-2,2-dichlorocyclopropyl]methyl ester Formula: C18H23Cl2NO4S MolecularWeight: 420.35052

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3CC3(Cl)Cl)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC[C@@H]3CC3(Cl)Cl)C

InChI

InChI=1S/C18H23Cl2NO4S/c1-12-7-13(2)10-21(9-12)26(23,24)16-5-3-14(4-6-16)17(22)25-11-15-8-18(15,19)20/h3-6,12-13,15H,7-11H2,1-2H3/t12-,13-,15+/m1/s1