4-[(2-butylbenzimidazol-1-yl)methyl]-2-methyl-6-nitro-phenol

Systemtic Name: 4-[(2-butylbenzimidazol-1-yl)methyl]-2-methyl-6-nitro-phenol Openeye Name: 4-[(2-butylbenzimidazol-1-yl)methyl]-2-methyl-6-nitro-phenol CAS Name: 4-[(2-butyl-1-benzimidazolyl)methyl]-2-methyl-6-nitrophenol IUPAC Name: 4-[(2-butylbenzimidazol-1-yl)methyl]-2-methyl-6-nitrophenol Traditional Name: 4-[(2-butylbenzimidazol-1-yl)methyl]-2-methyl-6-nitro-phenol Formula: C19H21N3O3 MolecularWeight: 339.38834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC3=CC(=C(C(=C3)[N+](=O)[O-])O)C

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC3=CC(=C(C(=C3)[N+](=O)[O-])O)C

InChI

InChI=1S/C19H21N3O3/c1-3-4-9-18-20-15-7-5-6-8-16(15)21(18)12-14-10-13(2)19(23)17(11-14)22(24)25/h5-8,10-11,23H,3-4,9,12H2,1-2H3