magnesium 3-[4-[[6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]prop-2-ynoic acid

Systemtic Name: magnesium 3-[4-[[6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]prop-2-ynoic acid Openeye Name: magnesium 3-[4-[[6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]prop-2-ynoic acid CAS Name: magnesium 3-[4-[[6-(1-methyl-2-benzimidazolyl)-2-propyl-1-benzimidazolyl]methyl]phenyl]-2-propynoic acid IUPAC Name: magnesium 3-[4-[[6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]prop-2-ynoic acid Traditional Name: magnesium 3-[4-[[6-(1-methylbenzimidazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]phenyl]propiolic acid Formula: C28H24MgN4O2+2 MolecularWeight: 472.82076

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1CC3=CC=C(C=C3)C#CC(=O)O)C=C(C=C2)C4=NC5=CC=CC=C5N4C.[Mg+2]

Isomeric SMILES

CCCC1=NC2=C(N1CC3=CC=C(C=C3)C#CC(=O)O)C=C(C=C2)C4=NC5=CC=CC=C5N4C.[Mg+2]

InChI

InChI=1S/C28H24N4O2.Mg/c1-3-6-26-29-23-15-14-21(28-30-22-7-4-5-8-24(22)31(28)2)17-25(23)32(26)18-20-11-9-19(10-12-20)13-16-27(33)34;/h4-5,7-12,14-15,17H,3,6,18H2,1-2H3,(H,33,34);/q;+2