2-(3-chloranylpropyl)-4-phenyl-isoquinolin-1-one

Systemtic Name: 2-(3-chloranylpropyl)-4-phenyl-isoquinolin-1-one Openeye Name: 2-(3-chloropropyl)-4-phenyl-isoquinolin-1-one CAS Name: 2-(3-chloropropyl)-4-phenyl-1-isoquinolinone IUPAC Name: 2-(3-chloropropyl)-4-phenylisoquinolin-1-one Traditional Name: 2-(3-chloropropyl)-4-phenyl-isocarbostyril Formula: C18H16ClNO MolecularWeight: 297.77874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C(=O)C3=CC=CC=C32)CCCCl

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C(=O)C3=CC=CC=C32)CCCCl

InChI

InChI=1S/C18H16ClNO/c19-11-6-12-20-13-17(14-7-2-1-3-8-14)15-9-4-5-10-16(15)18(20)21/h1-5,7-10,13H,6,11-12H2