2-[[3-(2-chloroethyl)-2-oxidanidyl-1,3,2-oxazaphosphinan-2-ium-2-yl]amino]butyl methanesulfonate

Systemtic Name: 2-[[3-(2-chloroethyl)-2-oxidanidyl-1,3,2-oxazaphosphinan-2-ium-2-yl]amino]butyl methanesulfonate Openeye Name: 2-[[3-(2-chloroethyl)-2-oxido-1,3,2-oxazaphosphinan-2-ium-2-yl]amino]butyl methanesulfonate CAS Name: methanesulfonic acid 2-[[3-(2-chloroethyl)-2-oxido-1,3,2-oxazaphosphorinan-2-ium-2-yl]amino]butyl ester IUPAC Name: 2-[[3-(2-chloroethyl)-2-oxido-1,3,2-oxazaphosphinan-2-ium-2-yl]amino]butyl methanesulfonate Traditional Name: methanesulfonic acid 2-[[3-(2-chloroethyl)-2-oxido-1,3,2-oxazaphosphorinan-2-ium-2-yl]amino]butyl ester Formula: C10H22ClN2O5PS MolecularWeight: 348.783841

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COS(=O)(=O)C)N[P+]1(N(CCCO1)CCCl)[O-]

Isomeric SMILES

CCC(COS(=O)(=O)C)N[P+]1(N(CCCO1)CCCl)[O-]

InChI

InChI=1S/C10H22ClN2O5PS/c1-3-10(9-18-20(2,15)16)12-19(14)13(7-5-11)6-4-8-17-19/h10H,3-9H2,1-2H3,(H,12,14)