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

Systemtic Name: 4-[1-(4-ethylpiperazin-1-yl)-4-(4-methoxyphenyl)isoquinolin-3-yl]butan-1-ol Openeye Name: 4-[1-(4-ethylpiperazin-1-yl)-4-(4-methoxyphenyl)-3-isoquinolyl]butan-1-ol CAS Name: 4-[1-(4-ethyl-1-piperazinyl)-4-(4-methoxyphenyl)-3-isoquinolinyl]-1-butanol IUPAC Name: 4-[1-(4-ethylpiperazin-1-yl)-4-(4-methoxyphenyl)isoquinolin-3-yl]butan-1-ol Traditional Name: 4-[1-(4-ethylpiperazino)-4-(4-methoxyphenyl)-3-isoquinolyl]butan-1-ol Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=C(C3=CC=CC=C32)C4=CC=C(C=C4)OC)CCCCO

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=C(C3=CC=CC=C32)C4=CC=C(C=C4)OC)CCCCO

InChI

InChI=1S/C26H33N3O2/c1-3-28-15-17-29(18-16-28)26-23-9-5-4-8-22(23)25(24(27-26)10-6-7-19-30)20-11-13-21(31-2)14-12-20/h4-5,8-9,11-14,30H,3,6-7,10,15-19H2,1-2H3