2-(1H-benzimidazol-2-yl)ethyl-[[2-(3,4-dimethoxyphenyl)-7-methoxy-quinolin-3-yl]methyl]azanium

Systemtic Name: 2-(1H-benzimidazol-2-yl)ethyl-[[2-(3,4-dimethoxyphenyl)-7-methoxy-quinolin-3-yl]methyl]azanium Openeye Name: 2-(1H-benzimidazol-2-yl)ethyl-[[2-(3,4-dimethoxyphenyl)-7-methoxy-3-quinolyl]methyl]ammonium CAS Name: 2-(1H-benzimidazol-2-yl)ethyl-[[2-(3,4-dimethoxyphenyl)-7-methoxy-3-quinolinyl]methyl]ammonium IUPAC Name: 2-(1H-benzimidazol-2-yl)ethyl-[[2-(3,4-dimethoxyphenyl)-7-methoxyquinolin-3-yl]methyl]azanium Traditional Name: 2-(1H-benzimidazol-2-yl)ethyl-[[2-(3,4-dimethoxyphenyl)-7-methoxy-3-quinolyl]methyl]ammonium Formula: C28H29N4O3+ MolecularWeight: 469.55486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)C[NH2+]CCC3=NC4=CC=CC=C4N3)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)C[NH2+]CCC3=NC4=CC=CC=C4N3)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C28H28N4O3/c1-33-21-10-8-18-14-20(17-29-13-12-27-30-22-6-4-5-7-23(22)31-27)28(32-24(18)16-21)19-9-11-25(34-2)26(15-19)35-3/h4-11,14-16,29H,12-13,17H2,1-3H3,(H,30,31)/p+1