2-isoquinolin-3-yl-1-(4-pyrrolidin-1-ylphenyl)ethanone

Systemtic Name: 2-isoquinolin-3-yl-1-(4-pyrrolidin-1-ylphenyl)ethanone Openeye Name: 2-(3-isoquinolyl)-1-(4-pyrrolidin-1-ylphenyl)ethanone CAS Name: 2-(3-isoquinolinyl)-1-[4-(1-pyrrolidinyl)phenyl]ethanone IUPAC Name: 2-isoquinolin-3-yl-1-(4-pyrrolidin-1-ylphenyl)ethanone Traditional Name: 2-(3-isoquinolyl)-1-(4-pyrrolidinophenyl)ethanone Formula: C21H20N2O MolecularWeight: 316.3963

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)C(=O)CC3=CC4=CC=CC=C4C=N3

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)C(=O)CC3=CC4=CC=CC=C4C=N3

InChI

InChI=1S/C21H20N2O/c24-21(14-19-13-17-5-1-2-6-18(17)15-22-19)16-7-9-20(10-8-16)23-11-3-4-12-23/h1-2,5-10,13,15H,3-4,11-12,14H2