methyl 3-[4-[[2-butyl-5-chloranyl-4-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]furan-2-carboxylate

Systemtic Name: methyl 3-[4-[[2-butyl-5-chloranyl-4-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]furan-2-carboxylate Openeye Name: methyl 3-[4-[[2-butyl-5-chloro-4-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]furan-2-carboxylate CAS Name: 3-[4-[[2-butyl-5-chloro-4-(hydroxymethyl)-1-imidazolyl]methyl]phenyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-[4-[[2-butyl-5-chloro-4-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]furan-2-carboxylate Traditional Name: 3-[4-[(2-butyl-5-chloro-4-methylol-imidazol-1-yl)methyl]phenyl]furan-2-carboxylic acid methyl ester Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=C(OC=C3)C(=O)OC)Cl)CO

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=C(OC=C3)C(=O)OC)Cl)CO

InChI

InChI=1S/C21H23ClN2O4/c1-3-4-5-18-23-17(13-25)20(22)24(18)12-14-6-8-15(9-7-14)16-10-11-28-19(16)21(26)27-2/h6-11,25H,3-5,12-13H2,1-2H3