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

Systemtic Name: methyl 3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-2-methylsulfonyl-benzoate Openeye Name: methyl 3-[4-(tert-butoxycarbonylamino)-1-piperidyl]-2-methylsulfonyl-benzoate CAS Name: 3-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-piperidinyl]-2-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-2-methylsulfonylbenzoate Traditional Name: 3-[4-(tert-butoxycarbonylamino)piperidino]-2-mesyl-benzoic acid methyl ester Formula: C19H28N2O6S MolecularWeight: 412.50042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(CC1)C2=CC=CC(=C2S(=O)(=O)C)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(CC1)C2=CC=CC(=C2S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C19H28N2O6S/c1-19(2,3)27-18(23)20-13-9-11-21(12-10-13)15-8-6-7-14(17(22)26-4)16(15)28(5,24)25/h6-8,13H,9-12H2,1-5H3,(H,20,23)