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

Systemtic Name: 1-[4-[4-(8-nitroisoquinolin-5-yl)oxyphenyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[4-[(8-nitro-5-isoquinolyl)oxy]phenyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[4-[(8-nitro-5-isoquinolinyl)oxy]phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-(8-nitroisoquinolin-5-yl)oxyphenyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-[(8-nitro-5-isoquinolyl)oxy]phenyl]piperazino]ethanone Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4/c1-15(26)23-10-12-24(13-11-23)16-2-4-17(5-3-16)29-21-7-6-20(25(27)28)19-14-22-9-8-18(19)21/h2-9,14H,10-13H2,1H3