methyl 2-[4-[(2-butyl-4-pyridin-2-yl-imidazol-1-yl)methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[(2-butyl-4-pyridin-2-yl-imidazol-1-yl)methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[2-butyl-4-(2-pyridyl)imidazol-1-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[2-butyl-4-(2-pyridinyl)-1-imidazolyl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(2-butyl-4-pyridin-2-ylimidazol-1-yl)methyl]phenyl]benzoate Traditional Name: 2-[4-[[2-butyl-4-(2-pyridyl)imidazol-1-yl]methyl]phenyl]benzoic acid methyl ester Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CN1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC)C4=CC=CC=N4

Isomeric SMILES

CCCCC1=NC(=CN1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC)C4=CC=CC=N4

InChI

InChI=1S/C27H27N3O2/c1-3-4-12-26-29-25(24-11-7-8-17-28-24)19-30(26)18-20-13-15-21(16-14-20)22-9-5-6-10-23(22)27(31)32-2/h5-11,13-17,19H,3-4,12,18H2,1-2H3