methyl 4-[2-imidazol-1-yl-1-oxidanyl-1-(4-pyridin-4-ylphenyl)ethyl]benzoate

Systemtic Name: methyl 4-[2-imidazol-1-yl-1-oxidanyl-1-(4-pyridin-4-ylphenyl)ethyl]benzoate Openeye Name: methyl 4-[1-hydroxy-2-imidazol-1-yl-1-[4-(4-pyridyl)phenyl]ethyl]benzoate CAS Name: 4-[1-hydroxy-2-(1-imidazolyl)-1-(4-pyridin-4-ylphenyl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-hydroxy-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethyl]benzoate Traditional Name: 4-[1-hydroxy-2-imidazol-1-yl-1-[4-(4-pyridyl)phenyl]ethyl]benzoic acid methyl ester Formula: C24H21N3O3 MolecularWeight: 399.44184

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(CN2C=CN=C2)(C3=CC=C(C=C3)C4=CC=NC=C4)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(CN2C=CN=C2)(C3=CC=C(C=C3)C4=CC=NC=C4)O

InChI

InChI=1S/C24H21N3O3/c1-30-23(28)20-4-8-22(9-5-20)24(29,16-27-15-14-26-17-27)21-6-2-18(3-7-21)19-10-12-25-13-11-19/h2-15,17,29H,16H2,1H3