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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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