2-pentan-3-yl-3H-benzimidazole-5-carboxylate

Systemtic Name: 2-pentan-3-yl-3H-benzimidazole-5-carboxylate Openeye Name: 2-(1-ethylpropyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-pentan-3-yl-3H-benzimidazole-5-carboxylate IUPAC Name: 2-pentan-3-yl-3H-benzimidazole-5-carboxylate Traditional Name: 2-(1-ethylpropyl)-3H-benzimidazole-5-carboxylate Formula: C13H15N2O2- MolecularWeight: 231.2704

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NC2=C(N1)C=C(C=C2)C(=O)[O-]

Isomeric SMILES

CCC(CC)C1=NC2=C(N1)C=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C13H16N2O2/c1-3-8(4-2)12-14-10-6-5-9(13(16)17)7-11(10)15-12/h5-8H,3-4H2,1-2H3,(H,14,15)(H,16,17)/p-1