[1-oxidanyl-6-(phenylmethoxycarbonylamino)-1-phosphono-hexyl]phosphonic acid

Systemtic Name: [1-oxidanyl-6-(phenylmethoxycarbonylamino)-1-phosphono-hexyl]phosphonic acid Openeye Name: [6-(benzyloxycarbonylamino)-1-hydroxy-1-phosphono-hexyl]phosphonic acid CAS Name: [1-hydroxy-6-(phenylmethoxycarbonylamino)-1-phosphonohexyl]phosphonic acid IUPAC Name: [1-hydroxy-6-(phenylmethoxycarbonylamino)-1-phosphonohexyl]phosphonic acid Traditional Name: [6-(benzyloxycarbonylamino)-1-hydroxy-1-phosphono-hexyl]phosphonic acid Formula: C14H23NO9P2 MolecularWeight: 411.281242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCCCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C14H23NO9P2/c16-13(24-11-12-7-3-1-4-8-12)15-10-6-2-5-9-14(17,25(18,19)20)26(21,22)23/h1,3-4,7-8,17H,2,5-6,9-11H2,(H,15,16)(H2,18,19,20)(H2,21,22,23)