methyl 4-[2-(1H-imidazol-2-yl)ethyl]benzoate

Systemtic Name: methyl 4-[2-(1H-imidazol-2-yl)ethyl]benzoate Openeye Name: methyl 4-[2-(1H-imidazol-2-yl)ethyl]benzoate CAS Name: 4-[2-(1H-imidazol-2-yl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(1H-imidazol-2-yl)ethyl]benzoate Traditional Name: 4-[2-(1H-imidazol-2-yl)ethyl]benzoic acid methyl ester Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCC2=NC=CN2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCC2=NC=CN2

InChI

InChI=1S/C13H14N2O2/c1-17-13(16)11-5-2-10(3-6-11)4-7-12-14-8-9-15-12/h2-3,5-6,8-9H,4,7H2,1H3,(H,14,15)