(2S)-1-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]carbonylpiperidine-2-carboxylic acid

Systemtic Name: (2S)-1-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]carbonylpiperidine-2-carboxylic acid Openeye Name: (2S)-1-[3-[cyclohexyl(methyl)sulfamoyl]benzoyl]piperidine-2-carboxylic acid CAS Name: (2S)-1-[[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: (2S)-1-[3-[cyclohexyl(methyl)sulfamoyl]benzoyl]piperidine-2-carboxylic acid Traditional Name: (2S)-1-[3-[cyclohexyl(methyl)sulfamoyl]benzoyl]pipecolinic acid Formula: C20H28N2O5S MolecularWeight: 408.51172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCCC3C(=O)O

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCC[C@H]3C(=O)O

InChI

InChI=1S/C20H28N2O5S/c1-21(16-9-3-2-4-10-16)28(26,27)17-11-7-8-15(14-17)19(23)22-13-6-5-12-18(22)20(24)25/h7-8,11,14,16,18H,2-6,9-10,12-13H2,1H3,(H,24,25)/t18-/m0/s1