1-[2-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]pyrrolidin-2-one

Systemtic Name: 1-[2-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]pyrrolidin-2-one Openeye Name: 1-[2-[4-(8-nitro-5-isoquinolyl)piperazin-1-yl]-2-oxo-ethyl]pyrrolidin-2-one CAS Name: 1-[2-[4-(8-nitro-5-isoquinolinyl)-1-piperazinyl]-2-oxoethyl]-2-pyrrolidinone IUPAC Name: 1-[2-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]-2-oxoethyl]pyrrolidin-2-one Traditional Name: 1-[2-keto-2-[4-(8-nitro-5-isoquinolyl)piperazino]ethyl]-2-pyrrolidone Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC(=O)N2CCN(CC2)C3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)CC(=O)N2CCN(CC2)C3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O4/c25-18-2-1-7-23(18)13-19(26)22-10-8-21(9-11-22)16-3-4-17(24(27)28)15-12-20-6-5-14(15)16/h3-6,12H,1-2,7-11,13H2