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

Systemtic Name: methyl 2-[4-[[2-butyl-1-chloranyl-5-(hydroxymethyl)imidazol-4-yl]methyl]phenoxy]butanoate Openeye Name: methyl 2-[4-[[2-butyl-1-chloro-5-(hydroxymethyl)imidazol-4-yl]methyl]phenoxy]butanoate CAS Name: 2-[4-[[2-butyl-1-chloro-5-(hydroxymethyl)-4-imidazolyl]methyl]phenoxy]butanoic acid methyl ester IUPAC Name: methyl 2-[4-[[2-butyl-1-chloro-5-(hydroxymethyl)imidazol-4-yl]methyl]phenoxy]butanoate Traditional Name: 2-[4-[(2-butyl-1-chloro-5-methylol-imidazol-4-yl)methyl]phenoxy]butyric acid methyl ester Formula: C20H27ClN2O4 MolecularWeight: 394.89238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1Cl)CO)CC2=CC=C(C=C2)OC(CC)C(=O)OC

Isomeric SMILES

CCCCC1=NC(=C(N1Cl)CO)CC2=CC=C(C=C2)OC(CC)C(=O)OC

InChI

InChI=1S/C20H27ClN2O4/c1-4-6-7-19-22-16(17(13-24)23(19)21)12-14-8-10-15(11-9-14)27-18(5-2)20(25)26-3/h8-11,18,24H,4-7,12-13H2,1-3H3