3-[4-[6-(3-fluoranylpropoxy)-3,4-dihydro-1H-isoquinolin-2-yl]cyclohexyl]-1H-indole-5-carbonitrile

Systemtic Name: 3-[4-[6-(3-fluoranylpropoxy)-3,4-dihydro-1H-isoquinolin-2-yl]cyclohexyl]-1H-indole-5-carbonitrile Openeye Name: 3-[4-[6-(3-fluoranylpropoxy)-3,4-dihydro-1H-isoquinolin-2-yl]cyclohexyl]-1H-indole-5-carbonitrile CAS Name: 3-[4-[6-(3-fluoranylpropoxy)-3,4-dihydro-1H-isoquinolin-2-yl]cyclohexyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[4-[6-(3-fluoranylpropoxy)-3,4-dihydro-1H-isoquinolin-2-yl]cyclohexyl]-1H-indole-5-carbonitrile Traditional Name: 3-[4-[6-(3-fluoranylpropoxy)-3,4-dihydro-1H-isoquinolin-2-yl]cyclohexyl]-1H-indole-5-carbonitrile Formula: C27H30FN3O MolecularWeight: 430.547538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CNC3=C2C=C(C=C3)C#N)N4CCC5=C(C4)C=CC(=C5)OCCCF

Isomeric SMILES

C1CC(CCC1C2=CNC3=C2C=C(C=C3)C#N)N4CCC5=C(C4)C=CC(=C5)OCCC[18F]

InChI

InChI=1S/C27H30FN3O/c28-11-1-13-32-24-8-5-22-18-31(12-10-21(22)15-24)23-6-3-20(4-7-23)26-17-30-27-9-2-19(16-29)14-25(26)27/h2,5,8-9,14-15,17,20,23,30H,1,3-4,6-7,10-13,18H2/i28-1