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5-(2-octadecoxyphenyl)-2-phenyl-4H-pyrazol-3-one

5-(2-octadecoxyphenyl)-2-phenyl-4H-pyrazol-3-one

Systemtic Name:5-(2-octadecoxyphenyl)-2-phenyl-4H-pyrazol-3-one
Openeye Name:5-(2-octadecoxyphenyl)-2-phenyl-4H-pyrazol-3-one
CAS Name:5-(2-octadecoxyphenyl)-2-phenyl-4H-pyrazol-3-one
IUPAC Name:5-(2-octadecoxyphenyl)-2-phenyl-4H-pyrazol-3-one
Traditional Name:2-phenyl-5-(2-stearyloxyphenyl)-2-pyrazolin-3-one
Formula: C33H48N2O2
MolecularWeight: 504.74642
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1C2=NN(C(=O)C2)C3=CC=CC=C3


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1C2=NN(C(=O)C2)C3=CC=CC=C3


InChI

InChI=1S/C33H48N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22-27-37-32-26-21-20-25-30(32)31-28-33(36)35(34-31)29-23-18-17-19-24-29/h17-21,23-26H,2-16,22,27-28H2,1H3


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