[(2S)-2-azanyl-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]ethyl] dihydrogen phosphate

Systemtic Name: [(2S)-2-azanyl-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]ethyl] dihydrogen phosphate Openeye Name: [(2S)-2-amino-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]ethyl] dihydrogen phosphate CAS Name: [(2S)-2-amino-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]ethyl] dihydrogen phosphate IUPAC Name: [(2S)-2-amino-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]ethyl] dihydrogen phosphate Traditional Name: [(2S)-2-amino-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]ethyl] dihydrogen phosphate Formula: C19H30N3O4P MolecularWeight: 395.432961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CN=C(N2)[C@@H](COP(=O)(O)O)N

InChI

InChI=1S/C19H30N3O4P/c1-2-3-4-5-6-7-8-15-9-11-16(12-10-15)18-13-21-19(22-18)17(20)14-26-27(23,24)25/h9-13,17H,2-8,14,20H2,1H3,(H,21,22)(H2,23,24,25)/t17-/m1/s1