1-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)sulfamoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)sulfamoyl]piperidine-3-carboxylic acid Openeye Name: 1-[benzyl(tert-butoxycarbonyl)sulfamoyl]piperidine-3-carboxylic acid CAS Name: 1-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)sulfamoyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]sulfamoyl]piperidine-3-carboxylic acid Traditional Name: 1-[benzyl(tert-butoxycarbonyl)sulfamoyl]nipecotic acid Formula: C18H26N2O6S MolecularWeight: 398.47384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)S(=O)(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)S(=O)(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C18H26N2O6S/c1-18(2,3)26-17(23)20(12-14-8-5-4-6-9-14)27(24,25)19-11-7-10-15(13-19)16(21)22/h4-6,8-9,15H,7,10-13H2,1-3H3,(H,21,22)