methyl 2-[4-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)methyl]phenyl]ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN2O3/c1-3-4-5-16-20-18(19)15(12-22)21(16)11-14-8-6-13(7-9-14)10-17(23)24-2/h6-9,12H,3-5,10-11H2,1-2H3