[(1S)-1-[1-[(4-cyanophenyl)methyl]-5,6-dimethoxy-benzimidazol-2-yl]propyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC(=C(C=C2N1CC3=CC=C(C=C3)C#N)OC)OC)[NH3+]

Isomeric SMILES

CC[C@@H](C1=NC2=CC(=C(C=C2N1CC3=CC=C(C=C3)C#N)OC)OC)[NH3+]

InChI

InChI=1S/C20H22N4O2/c1-4-15(22)20-23-16-9-18(25-2)19(26-3)10-17(16)24(20)12-14-7-5-13(11-21)6-8-14/h5-10,15H,4,12,22H2,1-3H3/p+1/t15-/m0/s1