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

Systemtic Name: cyclohexyl-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]methanol Openeye Name: cyclohexyl-[4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]methanol CAS Name: cyclohexyl-[4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]methanol IUPAC Name: cyclohexyl-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]methanol Traditional Name: cyclohexyl-[4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]methanol Formula: C28H35N3O MolecularWeight: 429.597

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(C5CCCCC5)O

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(C5CCCCC5)O

InChI

InChI=1S/C28H35N3O/c1-2-30-16-18-31(19-17-30)28-25-11-7-6-10-24(25)20-26(29-28)21-12-14-23(15-13-21)27(32)22-8-4-3-5-9-22/h6-7,10-15,20,22,27,32H,2-5,8-9,16-19H2,1H3