tert-butyl N-[3-[bis(2-cyanoethoxy)phosphoryloxy-ditritio-methyl]-4-oxidanyl-4-tritio-nonadec-1-en-3-yl]carbamate

Systemtic Name: tert-butyl N-[3-[bis(2-cyanoethoxy)phosphoryloxy-ditritio-methyl]-4-oxidanyl-4-tritio-nonadec-1-en-3-yl]carbamate Openeye Name: tert-butyl N-[1-[bis(2-cyanoethoxy)phosphoryloxy-ditritio-methyl]-2-hydroxy-2-tritio-1-vinyl-heptadecyl]carbamate CAS Name: N-[3-[bis(2-cyanoethoxy)phosphoryloxy-ditritiomethyl]-4-hydroxy-4-tritiononadec-1-en-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[bis(2-cyanoethoxy)phosphoryloxy-ditritiomethyl]-4-hydroxy-4-tritiononadec-1-en-3-yl]carbamate Traditional Name: N-[1-[bis(2-cyanoethoxy)phosphoryloxy-ditritio-methyl]-1-(1-hydroxy-1-tritio-hexadecyl)allyl]carbamic acid tert-butyl ester Formula: C31H56N3O7P MolecularWeight: 619.790329

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C(COP(=O)(OCCC#N)OCCC#N)(C=C)NC(=O)OC(C)(C)C)O

Isomeric SMILES

[3H]C([3H])(C(C=C)(C([3H])(CCCCCCCCCCCCCCC)O)NC(=O)OC(C)(C)C)OP(=O)(OCCC#N)OCCC#N

InChI

InChI=1S/C31H56N3O7P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-22-28(35)31(7-2,34-29(36)41-30(3,4)5)27-40-42(37,38-25-20-23-32)39-26-21-24-33/h7,28,35H,2,6,8-22,25-27H2,1,3-5H3,(H,34,36)/i27T2,28T