[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-pyridin-3-yl-methanol

Systemtic Name: [4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-pyridin-3-yl-methanol Openeye Name: [4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]-(3-pyridyl)methanol CAS Name: [4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]-(3-pyridinyl)methanol IUPAC Name: [4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-pyridin-3-ylmethanol Traditional Name: [4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]-(3-pyridyl)methanol Formula: C27H28N4O MolecularWeight: 424.53742

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(C5=CN=CC=C5)O

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(C5=CN=CC=C5)O

InChI

InChI=1S/C27H28N4O/c1-2-30-14-16-31(17-15-30)27-24-8-4-3-6-22(24)18-25(29-27)20-9-11-21(12-10-20)26(32)23-7-5-13-28-19-23/h3-13,18-19,26,32H,2,14-17H2,1H3