(2R)-1-(2-ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol

Systemtic Name: (2R)-1-(2-ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol Openeye Name: (2R)-1-(2-ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol CAS Name: (2R)-1-(2-ethyl-1-benzimidazolyl)-3-(4-nitrophenoxy)-2-propanol IUPAC Name: (2R)-1-(2-ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol Traditional Name: (2R)-1-(2-ethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol Formula: C18H19N3O4 MolecularWeight: 341.36116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2N1CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CCC1=NC2=CC=CC=C2N1C[C@H](COC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H19N3O4/c1-2-18-19-16-5-3-4-6-17(16)20(18)11-14(22)12-25-15-9-7-13(8-10-15)21(23)24/h3-10,14,22H,2,11-12H2,1H3/t14-/m1/s1