3-chloranyl-N-(3-pyridin-2-ylisoquinolin-1-yl)benzamide

Systemtic Name: 3-chloranyl-N-(3-pyridin-2-ylisoquinolin-1-yl)benzamide Openeye Name: 3-chloro-N-[3-(2-pyridyl)-1-isoquinolyl]benzamide CAS Name: 3-chloro-N-[3-(2-pyridinyl)-1-isoquinolinyl]benzamide IUPAC Name: 3-chloro-N-(3-pyridin-2-ylisoquinolin-1-yl)benzamide Traditional Name: 3-chloro-N-[3-(2-pyridyl)-1-isoquinolyl]benzamide Formula: C21H14ClN3O MolecularWeight: 359.80836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N=C2NC(=O)C3=CC(=CC=C3)Cl)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N=C2NC(=O)C3=CC(=CC=C3)Cl)C4=CC=CC=N4

InChI

InChI=1S/C21H14ClN3O/c22-16-8-5-7-15(12-16)21(26)25-20-17-9-2-1-6-14(17)13-19(24-20)18-10-3-4-11-23-18/h1-13H,(H,24,25,26)