2-[5,6-dimethyl-1-(3-oxidanylpropyl)benzimidazol-2-yl]ethylazanium

Systemtic Name: 2-[5,6-dimethyl-1-(3-oxidanylpropyl)benzimidazol-2-yl]ethylazanium Openeye Name: 2-[1-(3-hydroxypropyl)-5,6-dimethyl-benzimidazol-2-yl]ethylammonium CAS Name: 2-[1-(3-hydroxypropyl)-5,6-dimethyl-2-benzimidazolyl]ethylammonium IUPAC Name: 2-[1-(3-hydroxypropyl)-5,6-dimethylbenzimidazol-2-yl]ethylazanium Traditional Name: 2-[1-(3-hydroxypropyl)-5,6-dimethyl-benzimidazol-2-yl]ethylammonium Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)CC[NH3+])CCCO

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)CC[NH3+])CCCO

InChI

InChI=1S/C14H21N3O/c1-10-8-12-13(9-11(10)2)17(6-3-7-18)14(16-12)4-5-15/h8-9,18H,3-7,15H2,1-2H3/p+1