N-(ethylcarbamoyl)-2-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]ethanamide

Systemtic Name: N-(ethylcarbamoyl)-2-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]ethanamide Openeye Name: N-(ethylcarbamoyl)-2-[4-(8-nitro-5-isoquinolyl)piperazin-1-yl]acetamide CAS Name: N-(ethylcarbamoyl)-2-[4-(8-nitro-5-isoquinolinyl)-1-piperazinyl]acetamide IUPAC Name: N-(ethylcarbamoyl)-2-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]acetamide Traditional Name: N-(ethylcarbamoyl)-2-[4-(8-nitro-5-isoquinolyl)piperazino]acetamide Formula: C18H22N6O4 MolecularWeight: 386.40508

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)CN1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)NC(=O)CN1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H22N6O4/c1-2-20-18(26)21-17(25)12-22-7-9-23(10-8-22)15-3-4-16(24(27)28)14-11-19-6-5-13(14)15/h3-6,11H,2,7-10,12H2,1H3,(H2,20,21,25,26)