2-[4-(1-chloranylisoquinolin-3-yl)piperazin-1-yl]phenol

Systemtic Name: 2-[4-(1-chloranylisoquinolin-3-yl)piperazin-1-yl]phenol Openeye Name: 2-[4-(1-chloro-3-isoquinolyl)piperazin-1-yl]phenol CAS Name: 2-[4-(1-chloro-3-isoquinolinyl)-1-piperazinyl]phenol IUPAC Name: 2-[4-(1-chloroisoquinolin-3-yl)piperazin-1-yl]phenol Traditional Name: 2-[4-(1-chloro-3-isoquinolyl)piperazino]phenol Formula: C19H18ClN3O MolecularWeight: 339.81872

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2O)C3=CC4=CC=CC=C4C(=N3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2O)C3=CC4=CC=CC=C4C(=N3)Cl

InChI

InChI=1S/C19H18ClN3O/c20-19-15-6-2-1-5-14(15)13-18(21-19)23-11-9-22(10-12-23)16-7-3-4-8-17(16)24/h1-8,13,24H,9-12H2