2-[3-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-5-(2-hydroxyethyloxy)phenoxy]ethanol

Systemtic Name: 2-[3-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-5-(2-hydroxyethyloxy)phenoxy]ethanol Openeye Name: 2-[3-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-5-(2-hydroxyethoxy)phenoxy]ethanol CAS Name: 2-[3-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-5-(2-hydroxyethoxy)phenoxy]ethanol IUPAC Name: 2-[3-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-5-(2-hydroxyethoxy)phenoxy]ethanol Traditional Name: 2-[3-[1-(4-ethylpiperazino)-3-isoquinolyl]-5-(2-hydroxyethoxy)phenoxy]ethanol Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=CC(=C4)OCCO)OCCO

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=CC(=C4)OCCO)OCCO

InChI

InChI=1S/C25H31N3O4/c1-2-27-7-9-28(10-8-27)25-23-6-4-3-5-19(23)17-24(26-25)20-15-21(31-13-11-29)18-22(16-20)32-14-12-30/h3-6,15-18,29-30H,2,7-14H2,1H3