tert-butyl 4-(5-imidazol-1-yl-4-oxidanylidene-pentyl)benzoate

Systemtic Name: tert-butyl 4-(5-imidazol-1-yl-4-oxidanylidene-pentyl)benzoate Openeye Name: tert-butyl 4-(5-imidazol-1-yl-4-oxo-pentyl)benzoate CAS Name: 4-[5-(1-imidazolyl)-4-oxopentyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-imidazol-1-yl-4-oxopentyl)benzoate Traditional Name: 4-(5-imidazol-1-yl-4-keto-pentyl)benzoic acid tert-butyl ester Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)CCCC(=O)CN2C=CN=C2

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)CCCC(=O)CN2C=CN=C2

InChI

InChI=1S/C19H24N2O3/c1-19(2,3)24-18(23)16-9-7-15(8-10-16)5-4-6-17(22)13-21-12-11-20-14-21/h7-12,14H,4-6,13H2,1-3H3