[5-[[2-chloroethyl(nitroso)carbamoyl]-methyl-amino]-1-oxidanyl-1-phosphono-pentyl]phosphonic acid

Systemtic Name: [5-[[2-chloroethyl(nitroso)carbamoyl]-methyl-amino]-1-oxidanyl-1-phosphono-pentyl]phosphonic acid Openeye Name: [5-[[2-chloroethyl(nitroso)carbamoyl]-methyl-amino]-1-hydroxy-1-phosphono-pentyl]phosphonic acid CAS Name: [5-[[[2-chloroethyl(nitroso)amino]-oxomethyl]-methylamino]-1-hydroxy-1-phosphonopentyl]phosphonic acid IUPAC Name: [5-[[2-chloroethyl(nitroso)carbamoyl]-methylamino]-1-hydroxy-1-phosphonopentyl]phosphonic acid Traditional Name: [5-[[2-chloroethyl(nitroso)carbamoyl]-methyl-amino]-1-hydroxy-1-phosphono-pentyl]phosphonic acid Formula: C9H20ClN3O9P2 MolecularWeight: 411.670322

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCC(O)(P(=O)(O)O)P(=O)(O)O)C(=O)N(CCCl)N=O

Isomeric SMILES

CN(CCCCC(O)(P(=O)(O)O)P(=O)(O)O)C(=O)N(CCCl)N=O

InChI

InChI=1S/C9H20ClN3O9P2/c1-12(8(14)13(11-16)7-5-10)6-3-2-4-9(15,23(17,18)19)24(20,21)22/h15H,2-7H2,1H3,(H2,17,18,19)(H2,20,21,22)