2-ethoxyethyl N-(1,3-benzodioxol-5-ylcarbonyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidate

Systemtic Name: 2-ethoxyethyl N-(1,3-benzodioxol-5-ylcarbonyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidate Openeye Name: 2-ethoxyethyl N-(1,3-benzodioxole-5-carbonyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidate CAS Name: N-[1,3-benzodioxol-5-yl(oxo)methyl]-4-[3-(trifluoromethyl)phenyl]-1-piperazinecarboximidic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl N-(1,3-benzodioxole-5-carbonyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidate Traditional Name: N-piperonyloyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidic acid 2-ethoxyethyl ester Formula: C24H26F3N3O5 MolecularWeight: 493.47555

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=NC(=O)C1=CC2=C(C=C1)OCO2)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CCOCCOC(=NC(=O)C1=CC2=C(C=C1)OCO2)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C24H26F3N3O5/c1-2-32-12-13-33-23(28-22(31)17-6-7-20-21(14-17)35-16-34-20)30-10-8-29(9-11-30)19-5-3-4-18(15-19)24(25,26)27/h3-7,14-15H,2,8-13,16H2,1H3