5-chloranyl-3-[2-(4-isoquinolin-1-ylpiperazin-1-yl)ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 5-chloranyl-3-[2-(4-isoquinolin-1-ylpiperazin-1-yl)ethyl]-1,3-benzoxazol-2-one Openeye Name: 5-chloro-3-[2-[4-(1-isoquinolyl)piperazin-1-yl]ethyl]-1,3-benzoxazol-2-one CAS Name: 5-chloro-3-[2-[4-(1-isoquinolinyl)-1-piperazinyl]ethyl]-1,3-benzoxazol-2-one IUPAC Name: 5-chloro-3-[2-(4-isoquinolin-1-ylpiperazin-1-yl)ethyl]-1,3-benzoxazol-2-one Traditional Name: 5-chloro-3-[2-[4-(1-isoquinolyl)piperazino]ethyl]-1,3-benzoxazol-2-one Formula: C22H21ClN4O2 MolecularWeight: 408.88074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C3=C(C=CC(=C3)Cl)OC2=O)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCN2C3=C(C=CC(=C3)Cl)OC2=O)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C22H21ClN4O2/c23-17-5-6-20-19(15-17)27(22(28)29-20)14-11-25-9-12-26(13-10-25)21-18-4-2-1-3-16(18)7-8-24-21/h1-8,15H,9-14H2