(2S)-1-(2-azanylidene-3-butyl-benzimidazol-1-yl)-3-(4-methylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-(2-azanylidene-3-butyl-benzimidazol-1-yl)-3-(4-methylphenoxy)propan-2-ol Openeye Name: (2S)-1-(3-butyl-2-imino-benzimidazol-1-yl)-3-(4-methylphenoxy)propan-2-ol CAS Name: (2S)-1-(3-butyl-2-imino-1-benzimidazolyl)-3-(4-methylphenoxy)-2-propanol IUPAC Name: (2S)-1-(3-butyl-2-iminobenzimidazol-1-yl)-3-(4-methylphenoxy)propan-2-ol Traditional Name: (2S)-1-(3-butyl-2-imino-benzimidazol-1-yl)-3-(4-methylphenoxy)propan-2-ol Formula: C21H27N3O2 MolecularWeight: 353.45798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N(C1=N)CC(COC3=CC=C(C=C3)C)O

Isomeric SMILES

CCCCN1C2=CC=CC=C2N(C1=N)C[C@@H](COC3=CC=C(C=C3)C)O

InChI

InChI=1S/C21H27N3O2/c1-3-4-13-23-19-7-5-6-8-20(19)24(21(23)22)14-17(25)15-26-18-11-9-16(2)10-12-18/h5-12,17,22,25H,3-4,13-15H2,1-2H3/t17-/m0/s1