4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-4-methoxy-butan-2-ol

Systemtic Name: 4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-4-methoxy-butan-2-ol Openeye Name: 4-[4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]-4-methoxy-butan-2-ol CAS Name: 4-[4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]-4-methoxy-2-butanol IUPAC Name: 4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-4-methoxybutan-2-ol Traditional Name: 4-[4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]-4-methoxy-butan-2-ol Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O2/c1-4-28-13-15-29(16-14-28)26-23-8-6-5-7-22(23)18-24(27-26)20-9-11-21(12-10-20)25(31-3)17-19(2)30/h5-12,18-19,25,30H,4,13-17H2,1-3H3