3-chloranyl-N-isoquinolin-3-yl-butanamide

Systemtic Name: 3-chloranyl-N-isoquinolin-3-yl-butanamide Openeye Name: 3-chloro-N-(3-isoquinolyl)butanamide CAS Name: 3-chloro-N-(3-isoquinolinyl)butanamide IUPAC Name: 3-chloro-N-isoquinolin-3-ylbutanamide Traditional Name: 3-chloro-N-(3-isoquinolyl)butyramide Formula: C13H13ClN2O MolecularWeight: 248.70812

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC2=CC=CC=C2C=N1)Cl

Isomeric SMILES

CC(CC(=O)NC1=CC2=CC=CC=C2C=N1)Cl

InChI

InChI=1S/C13H13ClN2O/c1-9(14)6-13(17)16-12-7-10-4-2-3-5-11(10)8-15-12/h2-5,7-9H,6H2,1H3,(H,15,16,17)