[4-(6-nitrooxyhexanoylamino)-1-oxidanyl-1-phosphono-butyl]phosphonic acid

Systemtic Name: [4-(6-nitrooxyhexanoylamino)-1-oxidanyl-1-phosphono-butyl]phosphonic acid Openeye Name: [1-hydroxy-4-(6-nitrooxyhexanoylamino)-1-phosphono-butyl]phosphonic acid CAS Name: [1-hydroxy-4-[(6-nitrooxy-1-oxohexyl)amino]-1-phosphonobutyl]phosphonic acid IUPAC Name: [1-hydroxy-4-(6-nitrooxyhexanoylamino)-1-phosphonobutyl]phosphonic acid Traditional Name: [1-hydroxy-4-(6-nitrooxyhexanoylamino)-1-phosphono-butyl]phosphonic acid Formula: C10H22N2O11P2 MolecularWeight: 408.236002

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(=O)NCCCC(O)(P(=O)(O)O)P(=O)(O)O)CCO[N+](=O)[O-]

Isomeric SMILES

C(CCC(=O)NCCCC(O)(P(=O)(O)O)P(=O)(O)O)CCO[N+](=O)[O-]

InChI

InChI=1S/C10H22N2O11P2/c13-9(5-2-1-3-8-23-12(15)16)11-7-4-6-10(14,24(17,18)19)25(20,21)22/h14H,1-8H2,(H,11,13)(H2,17,18,19)(H2,20,21,22)