4-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]phenol

Systemtic Name: 4-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]phenol Openeye Name: 4-[4-(8-nitro-5-isoquinolyl)piperazin-1-yl]phenol CAS Name: 4-[4-(8-nitro-5-isoquinolinyl)-1-piperazinyl]phenol IUPAC Name: 4-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]phenol Traditional Name: 4-[4-(8-nitro-5-isoquinolyl)piperazino]phenol Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)O)C3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)O)C3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O3/c24-15-3-1-14(2-4-15)21-9-11-22(12-10-21)18-5-6-19(23(25)26)17-13-20-8-7-16(17)18/h1-8,13,24H,9-12H2