2-methyl-1-(1-pyridin-4-ylethyl)benzimidazole-5-carboxylic acid

Systemtic Name: 2-methyl-1-(1-pyridin-4-ylethyl)benzimidazole-5-carboxylic acid Openeye Name: 2-methyl-1-[1-(4-pyridyl)ethyl]benzimidazole-5-carboxylic acid CAS Name: 2-methyl-1-(1-pyridin-4-ylethyl)-5-benzimidazolecarboxylic acid IUPAC Name: 2-methyl-1-(1-pyridin-4-ylethyl)benzimidazole-5-carboxylic acid Traditional Name: 2-methyl-1-[1-(4-pyridyl)ethyl]benzimidazole-5-carboxylic acid Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C(C)C3=CC=NC=C3)C=CC(=C2)C(=O)O

Isomeric SMILES

CC1=NC2=C(N1C(C)C3=CC=NC=C3)C=CC(=C2)C(=O)O

InChI

InChI=1S/C16H15N3O2/c1-10(12-5-7-17-8-6-12)19-11(2)18-14-9-13(16(20)21)3-4-15(14)19/h3-10H,1-2H3,(H,20,21)