methyl 4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-3-sulfamoyl-benzoate

Systemtic Name: methyl 4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-3-sulfamoyl-benzoate Openeye Name: methyl 4-[4-(tert-butoxycarbonylamino)-1-piperidyl]-3-sulfamoyl-benzoate CAS Name: 4-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-piperidinyl]-3-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-3-sulfamoylbenzoate Traditional Name: 4-[4-(tert-butoxycarbonylamino)piperidino]-3-sulfamoyl-benzoic acid methyl ester Formula: C18H27N3O6S MolecularWeight: 413.48848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)S(=O)(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)S(=O)(=O)N

InChI

InChI=1S/C18H27N3O6S/c1-18(2,3)27-17(23)20-13-7-9-21(10-8-13)14-6-5-12(16(22)26-4)11-15(14)28(19,24)25/h5-6,11,13H,7-10H2,1-4H3,(H,20,23)(H2,19,24,25)