ethyl 3-[1-(1H-imidazol-5-yl)pentyl]-2-oxidanyl-benzoate

Systemtic Name: ethyl 3-[1-(1H-imidazol-5-yl)pentyl]-2-oxidanyl-benzoate Openeye Name: ethyl 2-hydroxy-3-[1-(1H-imidazol-5-yl)pentyl]benzoate CAS Name: 2-hydroxy-3-[1-(1H-imidazol-5-yl)pentyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-3-[1-(1H-imidazol-5-yl)pentyl]benzoate Traditional Name: 2-hydroxy-3-[1-(1H-imidazol-5-yl)pentyl]benzoic acid ethyl ester Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC(=C1O)C(=O)OCC)C2=CN=CN2

Isomeric SMILES

CCCCC(C1=CC=CC(=C1O)C(=O)OCC)C2=CN=CN2

InChI

InChI=1S/C17H22N2O3/c1-3-5-7-12(15-10-18-11-19-15)13-8-6-9-14(16(13)20)17(21)22-4-2/h6,8-12,20H,3-5,7H2,1-2H3,(H,18,19)