2-bromanyl-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide

Systemtic Name: 2-bromanyl-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Openeye Name: 2-bromo-N-[5-(1-piperidyl)-8-isoquinolyl]benzamide CAS Name: 2-bromo-N-[5-(1-piperidinyl)-8-isoquinolinyl]benzamide IUPAC Name: 2-bromo-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Traditional Name: 2-bromo-N-(5-piperidino-8-isoquinolyl)benzamide Formula: C21H20BrN3O MolecularWeight: 410.307

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4=CC=CC=C4Br

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C21H20BrN3O/c22-18-7-3-2-6-16(18)21(26)24-19-8-9-20(25-12-4-1-5-13-25)15-10-11-23-14-17(15)19/h2-3,6-11,14H,1,4-5,12-13H2,(H,24,26)