3-[1-[(4-cyanophenyl)methyl]-5,6-dimethoxy-benzimidazol-2-yl]propylazanium

Systemtic Name: 3-[1-[(4-cyanophenyl)methyl]-5,6-dimethoxy-benzimidazol-2-yl]propylazanium Openeye Name: 3-[1-[(4-cyanophenyl)methyl]-5,6-dimethoxy-benzimidazol-2-yl]propylammonium CAS Name: 3-[1-[(4-cyanophenyl)methyl]-5,6-dimethoxy-2-benzimidazolyl]propylammonium IUPAC Name: 3-[1-[(4-cyanophenyl)methyl]-5,6-dimethoxybenzimidazol-2-yl]propylazanium Traditional Name: 3-[1-(4-cyanobenzyl)-5,6-dimethoxy-benzimidazol-2-yl]propylammonium Formula: C20H23N4O2+ MolecularWeight: 351.42222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N2CC3=CC=C(C=C3)C#N)CCC[NH3+])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N2CC3=CC=C(C=C3)C#N)CCC[NH3+])OC

InChI

InChI=1S/C20H22N4O2/c1-25-18-10-16-17(11-19(18)26-2)24(20(23-16)4-3-9-21)13-15-7-5-14(12-22)6-8-15/h5-8,10-11H,3-4,9,13,21H2,1-2H3/p+1