2-[4-[1-(4-methylpiperazin-1-yl)isoquinolin-3-yl]phenoxy]ethanol

Systemtic Name: 2-[4-[1-(4-methylpiperazin-1-yl)isoquinolin-3-yl]phenoxy]ethanol Openeye Name: 2-[4-[1-(4-methylpiperazin-1-yl)-3-isoquinolyl]phenoxy]ethanol CAS Name: 2-[4-[1-(4-methyl-1-piperazinyl)-3-isoquinolinyl]phenoxy]ethanol IUPAC Name: 2-[4-[1-(4-methylpiperazin-1-yl)isoquinolin-3-yl]phenoxy]ethanol Traditional Name: 2-[4-[1-(4-methylpiperazino)-3-isoquinolyl]phenoxy]ethanol Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)OCCO

Isomeric SMILES

CN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)OCCO

InChI

InChI=1S/C22H25N3O2/c1-24-10-12-25(13-11-24)22-20-5-3-2-4-18(20)16-21(23-22)17-6-8-19(9-7-17)27-15-14-26/h2-9,16,26H,10-15H2,1H3