[(1R,2R)-1-azanyl-1-(6-octyl-1H-benzimidazol-2-yl)propan-2-yl] dihydrogen phosphate

Systemtic Name: [(1R,2R)-1-azanyl-1-(6-octyl-1H-benzimidazol-2-yl)propan-2-yl] dihydrogen phosphate Openeye Name: [(1R,2R)-2-amino-1-methyl-2-(6-octyl-1H-benzimidazol-2-yl)ethyl] dihydrogen phosphate CAS Name: [(1R,2R)-1-amino-1-(6-octyl-1H-benzimidazol-2-yl)propan-2-yl] dihydrogen phosphate IUPAC Name: [(1R,2R)-1-amino-1-(6-octyl-1H-benzimidazol-2-yl)propan-2-yl] dihydrogen phosphate Traditional Name: [(1R,2R)-2-amino-1-methyl-2-(6-octyl-1H-benzimidazol-2-yl)ethyl] dihydrogen phosphate Formula: C18H30N3O4P MolecularWeight: 383.422261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC2=C(C=C1)N=C(N2)C(C(C)OP(=O)(O)O)N

Isomeric SMILES

CCCCCCCCC1=CC2=C(C=C1)N=C(N2)[C@H]([C@@H](C)OP(=O)(O)O)N

InChI

InChI=1S/C18H30N3O4P/c1-3-4-5-6-7-8-9-14-10-11-15-16(12-14)21-18(20-15)17(19)13(2)25-26(22,23)24/h10-13,17H,3-9,19H2,1-2H3,(H,20,21)(H2,22,23,24)/t13-,17+/m1/s1