1-(5,6-dimethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol

Systemtic Name: 1-(5,6-dimethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol Openeye Name: 1-(5,6-dimethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol CAS Name: 1-(5,6-dimethyl-1-benzimidazolyl)-3-(4-nitrophenoxy)-2-propanol IUPAC Name: 1-(5,6-dimethylbenzimidazol-1-yl)-3-(4-nitrophenoxy)propan-2-ol Traditional Name: 1-(5,6-dimethylbenzimidazol-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:

CC1=CC2=C(C=C1C)N(C=N2)CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

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