2-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]propanamide

Systemtic Name: 2-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]propanamide Openeye Name: 2-[4-(8-nitro-5-isoquinolyl)piperazin-1-yl]propanamide CAS Name: 2-[4-(8-nitro-5-isoquinolinyl)-1-piperazinyl]propanamide IUPAC Name: 2-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]propanamide Traditional Name: 2-[4-(8-nitro-5-isoquinolyl)piperazino]propionamide Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)N1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N)N1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O3/c1-11(16(17)22)19-6-8-20(9-7-19)14-2-3-15(21(23)24)13-10-18-5-4-12(13)14/h2-5,10-11H,6-9H2,1H3,(H2,17,22)