6-(5-azanyl-5-propyl-cyclooctyl)oxy-7-chloranyl-2H-isoquinolin-1-one

Systemtic Name: 6-(5-azanyl-5-propyl-cyclooctyl)oxy-7-chloranyl-2H-isoquinolin-1-one Openeye Name: 6-(5-amino-5-propyl-cyclooctoxy)-7-chloro-2H-isoquinolin-1-one CAS Name: 6-(5-amino-5-propylcyclooctyl)oxy-7-chloro-2H-isoquinolin-1-one IUPAC Name: 6-(5-amino-5-propylcyclooctyl)oxy-7-chloro-2H-isoquinolin-1-one Traditional Name: 6-(5-amino-5-propyl-cyclooctoxy)-7-chloro-isocarbostyril Formula: C20H27ClN2O2 MolecularWeight: 362.89358

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCC(CCC1)OC2=C(C=C3C(=C2)C=CNC3=O)Cl)N

Isomeric SMILES

CCCC1(CCCC(CCC1)OC2=C(C=C3C(=C2)C=CNC3=O)Cl)N

InChI

InChI=1S/C20H27ClN2O2/c1-2-8-20(22)9-3-5-15(6-4-10-20)25-18-12-14-7-11-23-19(24)16(14)13-17(18)21/h7,11-13,15H,2-6,8-10,22H2,1H3,(H,23,24)