ethanedioic acid; 2-[(E)-2-(furan-3-yl)ethenyl]-5-methoxy-1-pyridin-2-yl-benzimidazole

Systemtic Name: ethanedioic acid; 2-[(E)-2-(furan-3-yl)ethenyl]-5-methoxy-1-pyridin-2-yl-benzimidazole Openeye Name: 2-[(E)-2-(3-furyl)vinyl]-5-methoxy-1-(2-pyridyl)benzimidazole; oxalic acid CAS Name: 2-[(E)-2-(3-furanyl)ethenyl]-5-methoxy-1-(2-pyridinyl)benzimidazole; oxalic acid IUPAC Name: 2-[(E)-2-(furan-3-yl)ethenyl]-5-methoxy-1-pyridin-2-ylbenzimidazole; oxalic acid Traditional Name: 2-[(E)-2-(3-furyl)vinyl]-5-methoxy-1-(2-pyridyl)benzimidazole; oxalic acid Formula: C21H17N3O6 MolecularWeight: 407.37618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=N2)C=CC3=COC=C3)C4=CC=CC=N4.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=N2)/C=C/C3=COC=C3)C4=CC=CC=N4.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H15N3O2.C2H2O4/c1-23-15-6-7-17-16(12-15)21-19(8-5-14-9-11-24-13-14)22(17)18-4-2-3-10-20-18;3-1(4)2(5)6/h2-13H,1H3;(H,3,4)(H,5,6)/b8-5+;