(4-oxidanylidene-4-phenyl-butyl) 4-chloranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (4-oxidanylidene-4-phenyl-butyl) 4-chloranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (4-oxo-4-phenyl-butyl) 4-chloro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)benzoic acid (4-oxo-4-phenylbutyl) ester IUPAC Name: (4-oxo-4-phenylbutyl) 4-chloro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-piperidinosulfonyl-benzoic acid (4-keto-4-phenyl-butyl) ester Formula: C22H24ClNO5S MolecularWeight: 449.94766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCCC(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCCC(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C22H24ClNO5S/c23-19-12-11-18(16-21(19)30(27,28)24-13-5-2-6-14-24)22(26)29-15-7-10-20(25)17-8-3-1-4-9-17/h1,3-4,8-9,11-12,16H,2,5-7,10,13-15H2