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2-[3-[3-(azepan-2-ylmethyl)phenoxy]propyl]isoindole-1,3-dione

2-[3-[3-(azepan-2-ylmethyl)phenoxy]propyl]isoindole-1,3-dione

Systemtic Name:2-[3-[3-(azepan-2-ylmethyl)phenoxy]propyl]isoindole-1,3-dione
Openeye Name:2-[3-[3-(azepan-2-ylmethyl)phenoxy]propyl]isoindoline-1,3-dione
CAS Name:2-[3-[3-(2-azepanylmethyl)phenoxy]propyl]isoindole-1,3-dione
IUPAC Name:2-[3-[3-(azepan-2-ylmethyl)phenoxy]propyl]isoindole-1,3-dione
Traditional Name:2-[3-[3-(azepan-2-ylmethyl)phenoxy]propyl]isoindoline-1,3-quinone
Formula: C24H28N2O3
MolecularWeight: 392.49072
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(NCC1)CC2=CC(=CC=C2)OCCCN3C(=O)C4=CC=CC=C4C3=O


Isomeric SMILES

C1CCC(NCC1)CC2=CC(=CC=C2)OCCCN3C(=O)C4=CC=CC=C4C3=O


InChI

InChI=1S/C24H28N2O3/c27-23-21-11-3-4-12-22(21)24(28)26(23)14-7-15-29-20-10-6-8-18(17-20)16-19-9-2-1-5-13-25-19/h3-4,6,8,10-12,17,19,25H,1-2,5,7,9,13-16H2


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