5-[1-(3-phenoxypropyl)benzimidazol-2-yl]pentylazanium

Systemtic Name: 5-[1-(3-phenoxypropyl)benzimidazol-2-yl]pentylazanium Openeye Name: 5-[1-(3-phenoxypropyl)benzimidazol-2-yl]pentylammonium CAS Name: 5-[1-(3-phenoxypropyl)-2-benzimidazolyl]pentylammonium IUPAC Name: 5-[1-(3-phenoxypropyl)benzimidazol-2-yl]pentylazanium Traditional Name: 5-[1-(3-phenoxypropyl)benzimidazol-2-yl]pentylammonium Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCN2C3=CC=CC=C3N=C2CCCCC[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)OCCCN2C3=CC=CC=C3N=C2CCCCC[NH3+]

InChI

InChI=1S/C21H27N3O/c22-15-8-2-5-14-21-23-19-12-6-7-13-20(19)24(21)16-9-17-25-18-10-3-1-4-11-18/h1,3-4,6-7,10-13H,2,5,8-9,14-17,22H2/p+1