[2-azanyl-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]-3-oxidanyl-propyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]-3-oxidanyl-propyl] dihydrogen phosphate Openeye Name: [2-amino-3-hydroxy-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]propyl] dihydrogen phosphate CAS Name: [2-amino-3-hydroxy-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]propyl] dihydrogen phosphate IUPAC Name: [2-amino-3-hydroxy-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]propyl] dihydrogen phosphate Traditional Name: [2-amino-3-hydroxy-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]propyl] dihydrogen phosphate Formula: C20H32N3O5P MolecularWeight: 425.458941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CN=C(N2)C(CO)(COP(=O)(O)O)N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CN=C(N2)C(CO)(COP(=O)(O)O)N

InChI

InChI=1S/C20H32N3O5P/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)18-13-22-19(23-18)20(21,14-24)15-28-29(25,26)27/h9-13,24H,2-8,14-15,21H2,1H3,(H,22,23)(H2,25,26,27)