ethyl 4-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)methyl]benzoate

Systemtic Name: ethyl 4-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)methyl]benzoate Openeye Name: ethyl 4-[(2-butyl-4-chloro-5-formyl-imidazol-1-yl)methyl]benzoate CAS Name: 4-[(2-butyl-4-chloro-5-formyl-1-imidazolyl)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-butyl-4-chloro-5-formylimidazol-1-yl)methyl]benzoate Traditional Name: 4-[(2-butyl-4-chloro-5-formyl-imidazol-1-yl)methyl]benzoic acid ethyl ester Formula: C18H21ClN2O3 MolecularWeight: 348.82394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C(=O)OCC)C=O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C(=O)OCC)C=O)Cl

InChI

InChI=1S/C18H21ClN2O3/c1-3-5-6-16-20-17(19)15(12-22)21(16)11-13-7-9-14(10-8-13)18(23)24-4-2/h7-10,12H,3-6,11H2,1-2H3