methyl 2-[4-[[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]methyl]phenoxy]benzoate

Systemtic Name: methyl 2-[4-[[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]methyl]phenoxy]benzoate Openeye Name: methyl 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]phenoxy]benzoate CAS Name: 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)-1-imidazolyl]methyl]phenoxy]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]phenoxy]benzoate Traditional Name: 2-[4-[(2-butyl-4-chloro-5-methylol-imidazol-1-yl)methyl]phenoxy]benzoic acid methyl ester Formula: C23H25ClN2O4 MolecularWeight: 428.9086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)OC3=CC=CC=C3C(=O)OC)CO)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)OC3=CC=CC=C3C(=O)OC)CO)Cl

InChI

InChI=1S/C23H25ClN2O4/c1-3-4-9-21-25-22(24)19(15-27)26(21)14-16-10-12-17(13-11-16)30-20-8-6-5-7-18(20)23(28)29-2/h5-8,10-13,27H,3-4,9,14-15H2,1-2H3