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

Systemtic Name: ethyl 2-[4-[[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]pyridine-3-carboxylate Openeye Name: ethyl 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]pyridine-3-carboxylate CAS Name: 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)-1-imidazolyl]methyl]phenyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]pyridine-3-carboxylate Traditional Name: 2-[4-[(2-butyl-4-chloro-5-methylol-imidazol-1-yl)methyl]phenyl]nicotinic acid ethyl ester Formula: C23H26ClN3O3 MolecularWeight: 427.92384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=C(C=CC=N3)C(=O)OCC)CO)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=C(C=CC=N3)C(=O)OCC)CO)Cl

InChI

InChI=1S/C23H26ClN3O3/c1-3-5-8-20-26-22(24)19(15-28)27(20)14-16-9-11-17(12-10-16)21-18(7-6-13-25-21)23(29)30-4-2/h6-7,9-13,28H,3-5,8,14-15H2,1-2H3