5-[5,6-dimethoxy-1-(3-oxidanylpropyl)benzimidazol-2-yl]pentylazanium

Systemtic Name: 5-[5,6-dimethoxy-1-(3-oxidanylpropyl)benzimidazol-2-yl]pentylazanium Openeye Name: 5-[1-(3-hydroxypropyl)-5,6-dimethoxy-benzimidazol-2-yl]pentylammonium CAS Name: 5-[1-(3-hydroxypropyl)-5,6-dimethoxy-2-benzimidazolyl]pentylammonium IUPAC Name: 5-[1-(3-hydroxypropyl)-5,6-dimethoxybenzimidazol-2-yl]pentylazanium Traditional Name: 5-[1-(3-hydroxypropyl)-5,6-dimethoxy-benzimidazol-2-yl]pentylammonium Formula: C17H28N3O3+ MolecularWeight: 322.42252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N2CCCO)CCCCC[NH3+])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N2CCCO)CCCCC[NH3+])OC

InChI

InChI=1S/C17H27N3O3/c1-22-15-11-13-14(12-16(15)23-2)20(9-6-10-21)17(19-13)7-4-3-5-8-18/h11-12,21H,3-10,18H2,1-2H3/p+1