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2,7-dihexylpyrene-4,5-dione

2,7-dihexylpyrene-4,5-dione

Systemtic Name:2,7-dihexylpyrene-4,5-dione
Openeye Name:2,7-dihexylpyrene-4,5-dione
CAS Name:2,7-dihexylpyrene-4,5-dione
IUPAC Name:2,7-dihexylpyrene-4,5-dione
Traditional Name:2,7-dihexylpyrene-4,5-quinone
Formula: C28H32O2
MolecularWeight: 400.55248
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C3C(=C1)C=CC4=CC(=CC(=C43)C(=O)C2=O)CCCCCC


Isomeric SMILES

CCCCCCC1=CC2=C3C(=C1)C=CC4=CC(=CC(=C43)C(=O)C2=O)CCCCCC


InChI

InChI=1S/C28H32O2/c1-3-5-7-9-11-19-15-21-13-14-22-16-20(12-10-8-6-4-2)18-24-26(22)25(21)23(17-19)27(29)28(24)30/h13-18H,3-12H2,1-2H3


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