5-butyl-1H-imidazole-4-carboxylic acid

Systemtic Name: 5-butyl-1H-imidazole-4-carboxylic acid Openeye Name: 5-butyl-1H-imidazole-4-carboxylic acid CAS Name: 5-butyl-1H-imidazole-4-carboxylic acid IUPAC Name: 5-butyl-1H-imidazole-4-carboxylic acid Traditional Name: 5-butyl-1H-imidazole-4-carboxylic acid Formula: C8H12N2O2 MolecularWeight: 168.19308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=CN1)C(=O)O

Isomeric SMILES

CCCCC1=C(N=CN1)C(=O)O

InChI

InChI=1S/C8H12N2O2/c1-2-3-4-6-7(8(11)12)10-5-9-6/h5H,2-4H2,1H3,(H,9,10)(H,11,12)