1-(2-butylbenzimidazol-1-yl)-3-(3-nitrophenoxy)propan-2-ol

Systemtic Name: 1-(2-butylbenzimidazol-1-yl)-3-(3-nitrophenoxy)propan-2-ol Openeye Name: 1-(2-butylbenzimidazol-1-yl)-3-(3-nitrophenoxy)propan-2-ol CAS Name: 1-(2-butyl-1-benzimidazolyl)-3-(3-nitrophenoxy)-2-propanol IUPAC Name: 1-(2-butylbenzimidazol-1-yl)-3-(3-nitrophenoxy)propan-2-ol Traditional Name: 1-(2-butylbenzimidazol-1-yl)-3-(3-nitrophenoxy)propan-2-ol Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC(COC3=CC=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC(COC3=CC=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H23N3O4/c1-2-3-11-20-21-18-9-4-5-10-19(18)22(20)13-16(24)14-27-17-8-6-7-15(12-17)23(25)26/h4-10,12,16,24H,2-3,11,13-14H2,1H3