methyl 6-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]hexanoate Openeye Name: methyl 6-[[2-chloro-5-(1-piperidylsulfonyl)benzoyl]amino]hexanoate CAS Name: 6-[[[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(2-chloro-5-piperidin-1-ylsulfonylbenzoyl)amino]hexanoate Traditional Name: 6-[(2-chloro-5-piperidinosulfonyl-benzoyl)amino]hexanoic acid methyl ester Formula: C19H27ClN2O5S MolecularWeight: 430.94608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)Cl

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)Cl

InChI

InChI=1S/C19H27ClN2O5S/c1-27-18(23)8-4-2-5-11-21-19(24)16-14-15(9-10-17(16)20)28(25,26)22-12-6-3-7-13-22/h9-10,14H,2-8,11-13H2,1H3,(H,21,24)