[3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]-4-nonan-5-yl-piperazin-1-yl] methanesulfonate

Systemtic Name: [3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]-4-nonan-5-yl-piperazin-1-yl] methanesulfonate Openeye Name: [3-[2-(tert-butoxycarbonylamino)propanoyl]-4-(1-butylpentyl)piperazin-1-yl] methanesulfonate CAS Name: methanesulfonic acid [3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]-4-nonan-5-yl-1-piperazinyl] ester IUPAC Name: [3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]-4-nonan-5-ylpiperazin-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-[2-(tert-butoxycarbonylamino)propanoyl]-4-(1-butylpentyl)piperazino] ester Formula: C22H43N3O6S MolecularWeight: 477.65832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)N1CCN(CC1C(=O)C(C)NC(=O)OC(C)(C)C)OS(=O)(=O)C

Isomeric SMILES

CCCCC(CCCC)N1CCN(CC1C(=O)C(C)NC(=O)OC(C)(C)C)OS(=O)(=O)C

InChI

InChI=1S/C22H43N3O6S/c1-8-10-12-18(13-11-9-2)25-15-14-24(31-32(7,28)29)16-19(25)20(26)17(3)23-21(27)30-22(4,5)6/h17-19H,8-16H2,1-7H3,(H,23,27)