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

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

Systemtic Name:2-[3-[3-[1-(azepan-1-yl)ethyl]phenoxy]propyl]isoindole-1,3-dione
Openeye Name:2-[3-[3-[1-(azepan-1-yl)ethyl]phenoxy]propyl]isoindoline-1,3-dione
CAS Name:2-[3-[3-[1-(1-azepanyl)ethyl]phenoxy]propyl]isoindole-1,3-dione
IUPAC Name:2-[3-[3-[1-(azepan-1-yl)ethyl]phenoxy]propyl]isoindole-1,3-dione
Traditional Name:2-[3-[3-[1-(azepan-1-yl)ethyl]phenoxy]propyl]isoindoline-1,3-quinone
Formula: C25H30N2O3
MolecularWeight: 406.5173
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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)OCCCN2C(=O)C3=CC=CC=C3C2=O)N4CCCCCC4


Isomeric SMILES

CC(C1=CC(=CC=C1)OCCCN2C(=O)C3=CC=CC=C3C2=O)N4CCCCCC4


InChI

InChI=1S/C25H30N2O3/c1-19(26-14-6-2-3-7-15-26)20-10-8-11-21(18-20)30-17-9-16-27-24(28)22-12-4-5-13-23(22)25(27)29/h4-5,8,10-13,18-19H,2-3,6-7,9,14-17H2,1H3


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