4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]cyclohex-3-en-1-ol

Systemtic Name: 4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]cyclohex-3-en-1-ol Openeye Name: 4-[4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]cyclohex-3-en-1-ol CAS Name: 4-[4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]-1-cyclohex-3-enol IUPAC Name: 4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]cyclohex-3-en-1-ol Traditional Name: 4-[4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]cyclohex-3-en-1-ol Formula: C27H31N3O MolecularWeight: 413.55454

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C5=CCC(CC5)O

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C5=CCC(CC5)O

InChI

InChI=1S/C27H31N3O/c1-2-29-15-17-30(18-16-29)27-25-6-4-3-5-23(25)19-26(28-27)22-9-7-20(8-10-22)21-11-13-24(31)14-12-21/h3-11,19,24,31H,2,12-18H2,1H3