6-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]hexanoic acid

Systemtic Name: 6-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]hexanoic acid Openeye Name: 6-[[4-chloro-3-(1-piperidylsulfonyl)benzoyl]amino]hexanoic acid CAS Name: 6-[[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(4-chloro-3-piperidin-1-ylsulfonylbenzoyl)amino]hexanoic acid Traditional Name: 6-[(4-chloro-3-piperidinosulfonyl-benzoyl)amino]hexanoic acid Formula: C18H25ClN2O5S MolecularWeight: 416.9195

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25ClN2O5S/c19-15-9-8-14(18(24)20-10-4-1-3-7-17(22)23)13-16(15)27(25,26)21-11-5-2-6-12-21/h8-9,13H,1-7,10-12H2,(H,20,24)(H,22,23)