[4-[5,6-dimethoxy-1-(3-oxidanylpropyl)benzimidazol-2-yl]phenyl]methylazanium

Systemtic Name: [4-[5,6-dimethoxy-1-(3-oxidanylpropyl)benzimidazol-2-yl]phenyl]methylazanium Openeye Name: [4-[1-(3-hydroxypropyl)-5,6-dimethoxy-benzimidazol-2-yl]phenyl]methylammonium CAS Name: [4-[1-(3-hydroxypropyl)-5,6-dimethoxy-2-benzimidazolyl]phenyl]methylammonium IUPAC Name: [4-[1-(3-hydroxypropyl)-5,6-dimethoxybenzimidazol-2-yl]phenyl]methylazanium Traditional Name: [4-[1-(3-hydroxypropyl)-5,6-dimethoxy-benzimidazol-2-yl]benzyl]ammonium Formula: C19H24N3O3+ MolecularWeight: 342.41216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N2CCCO)C3=CC=C(C=C3)C[NH3+])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N2CCCO)C3=CC=C(C=C3)C[NH3+])OC

InChI

InChI=1S/C19H23N3O3/c1-24-17-10-15-16(11-18(17)25-2)22(8-3-9-23)19(21-15)14-6-4-13(12-20)5-7-14/h4-7,10-11,23H,3,8-9,12,20H2,1-2H3/p+1