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3-chloranyl-6-(4-octylpiperazin-1-yl)benzo[b][1,4]benzoxazepine

3-chloranyl-6-(4-octylpiperazin-1-yl)benzo[b][1,4]benzoxazepine

Systemtic Name:3-chloranyl-6-(4-octylpiperazin-1-yl)benzo[b][1,4]benzoxazepine
Openeye Name:3-chloro-6-(4-octylpiperazin-1-yl)benzo[b][1,4]benzoxazepine
CAS Name:3-chloro-6-(4-octyl-1-piperazinyl)benzo[b][1,4]benzoxazepine
IUPAC Name:3-chloro-6-(4-octylpiperazin-1-yl)benzo[b][1,4]benzoxazepine
Traditional Name:3-chloro-6-(4-octylpiperazino)benzo[b][1,4]benzoxazepine
Formula: C25H32ClN3O
MolecularWeight: 425.99408
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)OC4=CC=CC=C42


Isomeric SMILES

CCCCCCCCN1CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)OC4=CC=CC=C42


InChI

InChI=1S/C25H32ClN3O/c1-2-3-4-5-6-9-14-28-15-17-29(18-16-28)25-21-10-7-8-11-23(21)30-24-13-12-20(26)19-22(24)27-25/h7-8,10-13,19H,2-6,9,14-18H2,1H3


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