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2-[5-[4-(2,6-diethylphenyl)phenoxy]pentyl]isoindole-1,3-dione

2-[5-[4-(2,6-diethylphenyl)phenoxy]pentyl]isoindole-1,3-dione

Systemtic Name:2-[5-[4-(2,6-diethylphenyl)phenoxy]pentyl]isoindole-1,3-dione
Openeye Name:2-[5-[4-(2,6-diethylphenyl)phenoxy]pentyl]isoindoline-1,3-dione
CAS Name:2-[5-[4-(2,6-diethylphenyl)phenoxy]pentyl]isoindole-1,3-dione
IUPAC Name:2-[5-[4-(2,6-diethylphenyl)phenoxy]pentyl]isoindole-1,3-dione
Traditional Name:2-[5-[4-(2,6-diethylphenyl)phenoxy]pentyl]isoindoline-1,3-quinone
Formula: C29H31NO3
MolecularWeight: 441.56134
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)C2=CC=C(C=C2)OCCCCCN3C(=O)C4=CC=CC=C4C3=O


Isomeric SMILES

CCC1=C(C(=CC=C1)CC)C2=CC=C(C=C2)OCCCCCN3C(=O)C4=CC=CC=C4C3=O


InChI

InChI=1S/C29H31NO3/c1-3-21-11-10-12-22(4-2)27(21)23-15-17-24(18-16-23)33-20-9-5-8-19-30-28(31)25-13-6-7-14-26(25)29(30)32/h6-7,10-18H,3-5,8-9,19-20H2,1-2H3


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