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

Systemtic Name: ethanedioic acid; 5-methoxy-2-[(E)-2-phenylethenyl]-1-pyridin-2-yl-benzimidazole Openeye Name: 5-methoxy-1-(2-pyridyl)-2-[(E)-styryl]benzimidazole; oxalic acid CAS Name: 5-methoxy-2-[(E)-2-phenylethenyl]-1-(2-pyridinyl)benzimidazole; oxalic acid IUPAC Name: 5-methoxy-2-[(E)-2-phenylethenyl]-1-pyridin-2-ylbenzimidazole; oxalic acid Traditional Name: 5-methoxy-1-(2-pyridyl)-2-[(E)-styryl]benzimidazole; oxalic acid Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N3O.C2H2O4/c1-25-17-11-12-19-18(15-17)23-21(13-10-16-7-3-2-4-8-16)24(19)20-9-5-6-14-22-20;3-1(4)2(5)6/h2-15H,1H3;(H,3,4)(H,5,6)/b13-10+;