3-[1-[4-(4-methylphenoxy)butyl]benzimidazol-2-yl]propylazanium

Systemtic Name: 3-[1-[4-(4-methylphenoxy)butyl]benzimidazol-2-yl]propylazanium Openeye Name: 3-[1-[4-(4-methylphenoxy)butyl]benzimidazol-2-yl]propylammonium CAS Name: 3-[1-[4-(4-methylphenoxy)butyl]-2-benzimidazolyl]propylammonium IUPAC Name: 3-[1-[4-(4-methylphenoxy)butyl]benzimidazol-2-yl]propylazanium Traditional Name: 3-[1-[4-(4-methylphenoxy)butyl]benzimidazol-2-yl]propylammonium Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCCN2C3=CC=CC=C3N=C2CCC[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)OCCCCN2C3=CC=CC=C3N=C2CCC[NH3+]

InChI

InChI=1S/C21H27N3O/c1-17-10-12-18(13-11-17)25-16-5-4-15-24-20-8-3-2-7-19(20)23-21(24)9-6-14-22/h2-3,7-8,10-13H,4-6,9,14-16,22H2,1H3/p+1