7-piperazin-1-yl-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: 7-piperazin-1-yl-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: 7-piperazin-1-yl-3,4-dihydro-2H-isoquinolin-1-one CAS Name: 7-(1-piperazinyl)-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: 7-piperazin-1-yl-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: 7-piperazino-3,4-dihydroisocarbostyril Formula: C13H17N3O MolecularWeight: 231.29358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C2=C1C=CC(=C2)N3CCNCC3

Isomeric SMILES

C1CNC(=O)C2=C1C=CC(=C2)N3CCNCC3

InChI

InChI=1S/C13H17N3O/c17-13-12-9-11(16-7-5-14-6-8-16)2-1-10(12)3-4-15-13/h1-2,9,14H,3-8H2,(H,15,17)