2-[4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]oxan-2-yl]ethanol

Systemtic Name: 2-[4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]oxan-2-yl]ethanol Openeye Name: 2-[4-[4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]tetrahydropyran-2-yl]ethanol CAS Name: 2-[4-[4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]-2-oxanyl]ethanol IUPAC Name: 2-[4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]oxan-2-yl]ethanol Traditional Name: 2-[4-[4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]tetrahydropyran-2-yl]ethanol Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C5CCOC(C5)CCO

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C5CCOC(C5)CCO

InChI

InChI=1S/C28H35N3O2/c1-2-30-13-15-31(16-14-30)28-26-6-4-3-5-24(26)20-27(29-28)22-9-7-21(8-10-22)23-12-18-33-25(19-23)11-17-32/h3-10,20,23,25,32H,2,11-19H2,1H3