[3-(4-fluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] methanesulfonate

Systemtic Name: [3-(4-fluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] methanesulfonate Openeye Name: [2-(tert-butoxycarbonylamino)-3-(4-fluorophenyl)propyl] methanesulfonate CAS Name: methanesulfonic acid [3-(4-fluorophenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl] ester IUPAC Name: [3-(4-fluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl] methanesulfonate Traditional Name: methanesulfonic acid [2-(tert-butoxycarbonylamino)-3-(4-fluorophenyl)propyl] ester Formula: C15H22FNO5S MolecularWeight: 347.402283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)F)COS(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)F)COS(=O)(=O)C

InChI

InChI=1S/C15H22FNO5S/c1-15(2,3)22-14(18)17-13(10-21-23(4,19)20)9-11-5-7-12(16)8-6-11/h5-8,13H,9-10H2,1-4H3,(H,17,18)