[(1S)-1-[1-[3-(4-ethylphenoxy)propyl]benzimidazol-2-yl]propyl]azanium

Systemtic Name: [(1S)-1-[1-[3-(4-ethylphenoxy)propyl]benzimidazol-2-yl]propyl]azanium Openeye Name: [(1S)-1-[1-[3-(4-ethylphenoxy)propyl]benzimidazol-2-yl]propyl]ammonium CAS Name: [(1S)-1-[1-[3-(4-ethylphenoxy)propyl]-2-benzimidazolyl]propyl]ammonium IUPAC Name: [(1S)-1-[1-[3-(4-ethylphenoxy)propyl]benzimidazol-2-yl]propyl]azanium Traditional Name: [(1S)-1-[1-[3-(4-ethylphenoxy)propyl]benzimidazol-2-yl]propyl]ammonium Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCCN2C3=CC=CC=C3N=C2C(CC)[NH3+]

Isomeric SMILES

CCC1=CC=C(C=C1)OCCCN2C3=CC=CC=C3N=C2[C@H](CC)[NH3+]

InChI

InChI=1S/C21H27N3O/c1-3-16-10-12-17(13-11-16)25-15-7-14-24-20-9-6-5-8-19(20)23-21(24)18(22)4-2/h5-6,8-13,18H,3-4,7,14-15,22H2,1-2H3/p+1/t18-/m0/s1