methyl 4-chloranyl-2-[4-(1H-imidazol-5-ylmethyl)phenyl]benzoate

Systemtic Name: methyl 4-chloranyl-2-[4-(1H-imidazol-5-ylmethyl)phenyl]benzoate Openeye Name: methyl 4-chloro-2-[4-(1H-imidazol-5-ylmethyl)phenyl]benzoate CAS Name: 4-chloro-2-[4-(1H-imidazol-5-ylmethyl)phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[4-(1H-imidazol-5-ylmethyl)phenyl]benzoate Traditional Name: 4-chloro-2-[4-(1H-imidazol-5-ylmethyl)phenyl]benzoic acid methyl ester Formula: C18H15ClN2O2 MolecularWeight: 326.7769

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)CC3=CN=CN3

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)CC3=CN=CN3

InChI

InChI=1S/C18H15ClN2O2/c1-23-18(22)16-7-6-14(19)9-17(16)13-4-2-12(3-5-13)8-15-10-20-11-21-15/h2-7,9-11H,8H2,1H3,(H,20,21)