[(1S)-2-oxidanylidenecyclohexyl] 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: [(1S)-2-oxocyclohexyl] 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid [(1S)-2-ketocyclohexyl] ester Formula: C18H22ClNO5S MolecularWeight: 399.88898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OC3CCCCC3=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O[C@H]3CCCCC3=O

InChI

InChI=1S/C18H22ClNO5S/c19-15-9-8-13(26(23,24)20-10-4-1-5-11-20)12-14(15)18(22)25-17-7-3-2-6-16(17)21/h8-9,12,17H,1-7,10-11H2/t17-/m0/s1