(E)-3-(1,3-benzodioxol-5-yl)-1-(2-chloro-4-fluorophenyl)prop-2-en-1-one → Ethyl 2-ethoxy-4-[N-(1-(2-piperidino-phenyl)-3-methyl-2-buten-1-yl)-aminocarbonylmethyl]-benzoate

Participants

Role	Name	HCID	Charge
Reactant	(E)-3-(1,3-benzodioxol-5-yl)-1-(2-chloro-4-fluorophenyl)prop-2-en-1-one	HCID 6293000	—
Reactant	Ethyl 2-benzyloxy-4-[N-{1-(2-piperidino-phenyl)-1-butyl}-aminocarbonylmethyl]-benzoate	HCID 21261753	—
Reactant	2-Allyloxy-4-[N-{1-(2-piperidino-phenyl)-1-butyl}-aminocarbonylmethyl]-benzoic acid	HCID 21261806	—
Reactant	2-Isopropoxy-4-[N-{1-(2-piperidino-phenyl)-1-butyl}-aminocarbonylmethyl]-benzoic acid	HCID 21261855	—
Reactant	2-Ethoxy-4-[N-{1-(5-methoxy-2-piperidino-phenyl)-1-butyl}-aminocarbonylmethyl]-benzoic acid	HCID 21261894	—
Product	Ethyl 2-ethoxy-4-[N-(1-(2-piperidino-phenyl)-3-methyl-2-buten-1-yl)-aminocarbonylmethyl]-benzoate	HCID 19025012	—

Reaction Steps

The mixing ratio of 75/25 is obtained from the corresponding ratio of intensities of the particularly characteristics signals in the 400 MHz-1H-NMR spectrum (CDCl3). The position of the signals is: 3-methyl-2-buten-1-yl compound: olefinic H: 5.25 (d), CH3: 1.64 (s) and 1.77 (s), benzylic <CH—6.00 (t), benzylic CH2—; 3.52 ppm (s) 3-methyl-1-butyl compound: CH3: 0.90 (d), benzylic <CH—5.35 (m), benzylic —CH2—; 3.54 ppm (s).

Provenance & Evidence

DOI	10.6084/m9.figshare.5104873.v1
Patent number	USRE037035E1
Source dataset	uspto-grants-2001_01
ORD ID	ord-fb84319e3baa480c8cdca48b6c5bce64
Source note	uspto-grants-2001_01