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9-{1-[4-(1H-1,2,4-triazol-1-yl)phenyl]piperidin-4-yl}-6-oxa-9-azaspiro[4.5]decane

ChemBase ID: 506424
Molecular Formular: C21H29N5O
Molecular Mass: 367.48786
Monoisotopic Mass: 367.23721057
SMILES and InChIs

SMILES:
n1(ncnc1)c1ccc(N2CCC(N3CC4(OCC3)CCCC4)CC2)cc1
Canonical SMILES:
C1CN(CC2(O1)CCCC2)C1CCN(CC1)c1ccc(cc1)n1cncn1
InChI:
InChI=1S/C21H29N5O/c1-2-10-21(9-1)15-25(13-14-27-21)19-7-11-24(12-8-19)18-3-5-20(6-4-18)26-17-22-16-23-26/h3-6,16-17,19H,1-2,7-15H2
InChIKey:
YXTDODYAOXSRRT-UHFFFAOYSA-N

Cite this record

CBID:506424 http://www.chembase.cn/molecule-506424.html

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