[[1-(aminomethyl)-4-ethanoyl-cyclohexyl]-oxidanyl-phosphono-methyl]phosphonic acid

Systemtic Name: [[1-(aminomethyl)-4-ethanoyl-cyclohexyl]-oxidanyl-phosphono-methyl]phosphonic acid Openeye Name: [[4-acetyl-1-(aminomethyl)cyclohexyl]-hydroxy-phosphono-methyl]phosphonic acid CAS Name: [[4-acetyl-1-(aminomethyl)cyclohexyl]-hydroxy-phosphonomethyl]phosphonic acid IUPAC Name: [[4-acetyl-1-(aminomethyl)cyclohexyl]-hydroxy-phosphonomethyl]phosphonic acid Traditional Name: [[4-acetyl-1-(aminomethyl)cyclohexyl]-hydroxy-phosphono-methyl]phosphonic acid Formula: C10H21NO8P2 MolecularWeight: 345.223162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CCC(CC1)(CN)C(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(=O)C1CCC(CC1)(CN)C(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C10H21NO8P2/c1-7(12)8-2-4-9(6-11,5-3-8)10(13,20(14,15)16)21(17,18)19/h8,13H,2-6,11H2,1H3,(H2,14,15,16)(H2,17,18,19)