(2Z)-2-[5-ethoxy-2-(phenylmethyl)-1H-pyrazol-3-ylidene]benzimidazole-4-carboxylic acid

Systemtic Name: (2Z)-2-[5-ethoxy-2-(phenylmethyl)-1H-pyrazol-3-ylidene]benzimidazole-4-carboxylic acid Openeye Name: (2Z)-2-(2-benzyl-5-ethoxy-1H-pyrazol-3-ylidene)benzimidazole-4-carboxylic acid CAS Name: (2Z)-2-[5-ethoxy-2-(phenylmethyl)-1H-pyrazol-3-ylidene]-4-benzimidazolecarboxylic acid IUPAC Name: (2Z)-2-(2-benzyl-5-ethoxy-1H-pyrazol-3-ylidene)benzimidazole-4-carboxylic acid Traditional Name: (2Z)-2-(2-benzyl-5-ethoxy-3-pyrazolin-3-ylidene)benzimidazole-4-carboxylic acid Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C2N=C3C=CC=C(C3=N2)C(=O)O)N(N1)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=C/C(=C/2\N=C3C=CC=C(C3=N2)C(=O)O)/N(N1)CC4=CC=CC=C4

InChI

InChI=1S/C20H18N4O3/c1-2-27-17-11-16(24(23-17)12-13-7-4-3-5-8-13)19-21-15-10-6-9-14(20(25)26)18(15)22-19/h3-11,23H,2,12H2,1H3,(H,25,26)/b19-16-