4-[(2-butyl-3-methanoyl-2H-imidazol-1-yl)methyl]benzoic acid

Systemtic Name: 4-[(2-butyl-3-methanoyl-2H-imidazol-1-yl)methyl]benzoic acid Openeye Name: 4-[(2-butyl-3-formyl-2H-imidazol-1-yl)methyl]benzoic acid CAS Name: 4-[(2-butyl-3-formyl-2H-imidazol-1-yl)methyl]benzoic acid IUPAC Name: 4-[(2-butyl-3-formyl-2H-imidazol-1-yl)methyl]benzoic acid Traditional Name: 4-[(2-butyl-3-formyl-4-imidazolin-1-yl)methyl]benzoic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N(C=CN1C=O)CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCC1N(C=CN1C=O)CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H20N2O3/c1-2-3-4-15-17(9-10-18(15)12-19)11-13-5-7-14(8-6-13)16(20)21/h5-10,12,15H,2-4,11H2,1H3,(H,20,21)