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1-[4-[1-(2-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]butan-1-one

1-[4-[1-(2-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]butan-1-one

Systemtic Name:1-[4-[1-(2-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]butan-1-one
Openeye Name:1-[4-[1-(2-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]butan-1-one
CAS Name:1-[4-[1-(2-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]-1-butanone
IUPAC Name:1-[4-[1-(2-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]butan-1-one
Traditional Name:1-[4-[1-(2-ethylpiperazino)-3-isoquinolyl]phenyl]butan-1-one
Formula: C25H29N3O
MolecularWeight: 387.51726
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCNCC4CC


Isomeric SMILES

CCCC(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCNCC4CC


InChI

InChI=1S/C25H29N3O/c1-3-7-24(29)19-12-10-18(11-13-19)23-16-20-8-5-6-9-22(20)25(27-23)28-15-14-26-17-21(28)4-2/h5-6,8-13,16,21,26H,3-4,7,14-15,17H2,1-2H3


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