2-[3-(1-chloranylisoquinolin-5-yl)oxypropyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(1-chloranylisoquinolin-5-yl)oxypropyl]isoindole-1,3-dione Openeye Name: 2-[3-[(1-chloro-5-isoquinolyl)oxy]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[(1-chloro-5-isoquinolinyl)oxy]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(1-chloroisoquinolin-5-yl)oxypropyl]isoindole-1,3-dione Traditional Name: 2-[3-[(1-chloro-5-isoquinolyl)oxy]propyl]isoindoline-1,3-quinone Formula: C20H15ClN2O3 MolecularWeight: 366.7977

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCOC3=CC=CC4=C3C=CN=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCOC3=CC=CC4=C3C=CN=C4Cl

InChI

InChI=1S/C20H15ClN2O3/c21-18-14-7-3-8-17(13(14)9-10-22-18)26-12-4-11-23-19(24)15-5-1-2-6-16(15)20(23)25/h1-3,5-10H,4,11-12H2