[(1S)-2,2-bis(chloranyl)cyclopropyl]methyl 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [(1S)-2,2-bis(chloranyl)cyclopropyl]methyl 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: [(1S)-2,2-dichlorocyclopropyl]methyl 2-morpholino-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)benzoic acid [(1S)-2,2-dichlorocyclopropyl]methyl ester IUPAC Name: [(1S)-2,2-dichlorocyclopropyl]methyl 2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-morpholino-5-piperidinosulfonyl-benzoic acid [(1S)-2,2-dichlorocyclopropyl]methyl ester Formula: C20H26Cl2N2O5S MolecularWeight: 477.40184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOCC3)C(=O)OCC4CC4(Cl)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOCC3)C(=O)OC[C@@H]4CC4(Cl)Cl

InChI

InChI=1S/C20H26Cl2N2O5S/c21-20(22)13-15(20)14-29-19(25)17-12-16(30(26,27)24-6-2-1-3-7-24)4-5-18(17)23-8-10-28-11-9-23/h4-5,12,15H,1-3,6-11,13-14H2/t15-/m0/s1