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

Systemtic Name: 3-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]butan-1-ol Openeye Name: 3-[4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]butan-1-ol CAS Name: 3-[4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]-1-butanol IUPAC Name: 3-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]butan-1-ol Traditional Name: 3-[4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]butan-1-ol Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(C)CCO

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(C)CCO

InChI

InChI=1S/C25H31N3O/c1-3-27-13-15-28(16-14-27)25-23-7-5-4-6-22(23)18-24(26-25)21-10-8-20(9-11-21)19(2)12-17-29/h4-11,18-19,29H,3,12-17H2,1-2H3