N-(1,3-benzodioxol-5-ylmethyl)-3-[3,5-bis(fluoranyl)phenyl]-N-(3-piperidin-1-ylpropyl)-1,2-oxazol-5-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[3,5-bis(fluoranyl)phenyl]-N-(3-piperidin-1-ylpropyl)-1,2-oxazol-5-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3,5-difluorophenyl)-N-[3-(1-piperidyl)propyl]isoxazol-5-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3,5-difluorophenyl)-N-[3-(1-piperidinyl)propyl]-5-isoxazolamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3,5-difluorophenyl)-N-(3-piperidin-1-ylpropyl)-1,2-oxazol-5-amine Traditional Name: [3-(3,5-difluorophenyl)isoxazol-5-yl]-(3-piperidinopropyl)-piperonyl-amine Formula: C25H27F2N3O3 MolecularWeight: 455.496986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN(CC2=CC3=C(C=C2)OCO3)C4=CC(=NO4)C5=CC(=CC(=C5)F)F

Isomeric SMILES

C1CCN(CC1)CCCN(CC2=CC3=C(C=C2)OCO3)C4=CC(=NO4)C5=CC(=CC(=C5)F)F

InChI

InChI=1S/C25H27F2N3O3/c26-20-12-19(13-21(27)14-20)22-15-25(33-28-22)30(10-4-9-29-7-2-1-3-8-29)16-18-5-6-23-24(11-18)32-17-31-23/h5-6,11-15H,1-4,7-10,16-17H2