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4-[4-(5-decyl-2-pyrimidin-2-yl-phenyl)phenyl]butanoate

4-[4-(5-decyl-2-pyrimidin-2-yl-phenyl)phenyl]butanoate

Systemtic Name:4-[4-(5-decyl-2-pyrimidin-2-yl-phenyl)phenyl]butanoate
Openeye Name:4-[4-(5-decyl-2-pyrimidin-2-yl-phenyl)phenyl]butanoate
CAS Name:4-[4-[5-decyl-2-(2-pyrimidinyl)phenyl]phenyl]butanoate
IUPAC Name:4-[4-(5-decyl-2-pyrimidin-2-ylphenyl)phenyl]butanoate
Traditional Name:4-[4-[5-decyl-2-(2-pyrimidyl)phenyl]phenyl]butyrate
Formula: C30H37N2O2-
MolecularWeight: 457.62698
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(C=C1)C2=NC=CC=N2)C3=CC=C(C=C3)CCCC(=O)[O-]


Isomeric SMILES

CCCCCCCCCCC1=CC(=C(C=C1)C2=NC=CC=N2)C3=CC=C(C=C3)CCCC(=O)[O-]


InChI

InChI=1S/C30H38N2O2/c1-2-3-4-5-6-7-8-9-12-25-17-20-27(30-31-21-11-22-32-30)28(23-25)26-18-15-24(16-19-26)13-10-14-29(33)34/h11,15-23H,2-10,12-14H2,1H3,(H,33,34)/p-1


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