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6-(5-decylpyrimidin-2-yl)-2-octyl-2,3-dihydroinden-1-one

6-(5-decylpyrimidin-2-yl)-2-octyl-2,3-dihydroinden-1-one

Systemtic Name:6-(5-decylpyrimidin-2-yl)-2-octyl-2,3-dihydroinden-1-one
Openeye Name:6-(5-decylpyrimidin-2-yl)-2-octyl-indan-1-one
CAS Name:6-(5-decyl-2-pyrimidinyl)-2-octyl-2,3-dihydroinden-1-one
IUPAC Name:6-(5-decylpyrimidin-2-yl)-2-octyl-2,3-dihydroinden-1-one
Traditional Name:6-(5-decylpyrimidin-2-yl)-2-octyl-indan-1-one
Formula: C31H46N2O
MolecularWeight: 462.70974
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC3=C(CC(C3=O)CCCCCCCC)C=C2


Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC3=C(CC(C3=O)CCCCCCCC)C=C2


InChI

InChI=1S/C31H46N2O/c1-3-5-7-9-11-12-13-15-17-25-23-32-31(33-24-25)28-20-19-26-21-27(30(34)29(26)22-28)18-16-14-10-8-6-4-2/h19-20,22-24,27H,3-18,21H2,1-2H3


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