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3-(23-bromanyl-6,12-dimethyl-pentacosan-12-yl)-1H-pyridazin-6-one

3-(23-bromanyl-6,12-dimethyl-pentacosan-12-yl)-1H-pyridazin-6-one

Systemtic Name:3-(23-bromanyl-6,12-dimethyl-pentacosan-12-yl)-1H-pyridazin-6-one
Openeye Name:3-[12-bromo-1-methyl-1-(6-methylundecyl)tetradecyl]-1H-pyridazin-6-one
CAS Name:3-(23-bromo-6,12-dimethylpentacosan-12-yl)-1H-pyridazin-6-one
IUPAC Name:3-(23-bromo-6,12-dimethylpentacosan-12-yl)-1H-pyridazin-6-one
Traditional Name:3-[12-bromo-1-methyl-1-(6-methylundecyl)tetradecyl]-1H-pyridazin-6-one
Formula: C31H57BrN2O
MolecularWeight: 553.70108
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CCCCCC(C)(CCCCCCCCCCC(CC)Br)C1=NNC(=O)C=C1


Isomeric SMILES

CCCCCC(C)CCCCCC(C)(CCCCCCCCCCC(CC)Br)C1=NNC(=O)C=C1


InChI

InChI=1S/C31H57BrN2O/c1-5-7-15-20-27(3)21-16-14-19-26-31(4,29-23-24-30(35)34-33-29)25-18-13-11-9-8-10-12-17-22-28(32)6-2/h23-24,27-28H,5-22,25-26H2,1-4H3,(H,34,35)


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