4-oxidanylidenepentyl 3-imidazol-1-ylbenzoate

Systemtic Name: 4-oxidanylidenepentyl 3-imidazol-1-ylbenzoate Openeye Name: 4-oxopentyl 3-imidazol-1-ylbenzoate CAS Name: 3-(1-imidazolyl)benzoic acid 4-oxopentyl ester IUPAC Name: 4-oxopentyl 3-imidazol-1-ylbenzoate Traditional Name: 3-imidazol-1-ylbenzoic acid 4-ketopentyl ester Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCOC(=O)C1=CC(=CC=C1)N2C=CN=C2

Isomeric SMILES

CC(=O)CCCOC(=O)C1=CC(=CC=C1)N2C=CN=C2

InChI

InChI=1S/C15H16N2O3/c1-12(18)4-3-9-20-15(19)13-5-2-6-14(10-13)17-8-7-16-11-17/h2,5-8,10-11H,3-4,9H2,1H3