[2-[[2-chloroethyl(nitroso)carbamoyl]amino]-1-oxidanyl-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-[[2-chloroethyl(nitroso)carbamoyl]amino]-1-oxidanyl-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-[[2-chloroethyl(nitroso)carbamoyl]amino]-1-hydroxy-1-phosphono-ethyl]phosphonic acid CAS Name: [2-[[[2-chloroethyl(nitroso)amino]-oxomethyl]amino]-1-hydroxy-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-[[2-chloroethyl(nitroso)carbamoyl]amino]-1-hydroxy-1-phosphonoethyl]phosphonic acid Traditional Name: [2-[[2-chloroethyl(nitroso)carbamoyl]amino]-1-hydroxy-1-phosphono-ethyl]phosphonic acid Formula: C5H12ClN3O9P2 MolecularWeight: 355.564002

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Descriptors Computed from Structure

Canonical SMILES:

C(CCl)N(C(=O)NCC(O)(P(=O)(O)O)P(=O)(O)O)N=O

Isomeric SMILES

C(CCl)N(C(=O)NCC(O)(P(=O)(O)O)P(=O)(O)O)N=O

InChI

InChI=1S/C5H12ClN3O9P2/c6-1-2-9(8-12)4(10)7-3-5(11,19(13,14)15)20(16,17)18/h11H,1-3H2,(H,7,10)(H2,13,14,15)(H2,16,17,18)