tert-butyl N-(1-diethoxyphosphoryl-4-oxidanyl-5,5,6,6-tetratritio-tridecan-3-yl)carbamate

Systemtic Name: tert-butyl N-(1-diethoxyphosphoryl-4-oxidanyl-5,5,6,6-tetratritio-tridecan-3-yl)carbamate Openeye Name: tert-butyl N-[1-(2-diethoxyphosphorylethyl)-2-hydroxy-3,3,4,4-tetratritio-undecyl]carbamate CAS Name: N-(1-diethoxyphosphoryl-4-hydroxy-5,5,6,6-tetratritiotridecan-3-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-diethoxyphosphoryl-4-hydroxy-5,5,6,6-tetratritiotridecan-3-yl)carbamate Traditional Name: N-[1-(2-diethoxyphosphorylethyl)-2-hydroxy-3,3,4,4-tetratritio-undecyl]carbamic acid tert-butyl ester Formula: C22H46NO6P MolecularWeight: 459.609938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(CCP(=O)(OCC)OCC)NC(=O)OC(C)(C)C)O

Isomeric SMILES

[3H]C([3H])(CCCCCCC)C([3H])([3H])C(C(CCP(=O)(OCC)OCC)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C22H46NO6P/c1-7-10-11-12-13-14-15-16-20(24)19(23-21(25)29-22(4,5)6)17-18-30(26,27-8-2)28-9-3/h19-20,24H,7-18H2,1-6H3,(H,23,25)/i15T2,16T2