4-[2-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]piperidin-1-yl]-2-imidazol-1-yl-pyrimidine

Systemtic Name: 4-[2-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]piperidin-1-yl]-2-imidazol-1-yl-pyrimidine Openeye Name: 4-[2-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-piperidyl]-2-imidazol-1-yl-pyrimidine CAS Name: 4-[2-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-piperidinyl]-2-(1-imidazolyl)pyrimidine IUPAC Name: 4-[2-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]piperidin-1-yl]-2-imidazol-1-ylpyrimidine Traditional Name: 2-imidazol-1-yl-4-[2-(2-piperonyloxyethyl)piperidino]pyrimidine Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCOCC2=CC3=C(C=C2)OCO3)C4=NC(=NC=C4)N5C=CN=C5

Isomeric SMILES

C1CCN(C(C1)CCOCC2=CC3=C(C=C2)OCO3)C4=NC(=NC=C4)N5C=CN=C5

InChI

InChI=1S/C22H25N5O3/c1-2-10-27(21-6-8-24-22(25-21)26-11-9-23-15-26)18(3-1)7-12-28-14-17-4-5-19-20(13-17)30-16-29-19/h4-6,8-9,11,13,15,18H,1-3,7,10,12,14,16H2