2-[6-nitro-3-(2-oxidanylidene-2-pyridin-3-yl-ethyl)quinoxalin-2-yl]-1-pyridin-3-yl-ethanone

Systemtic Name: 2-[6-nitro-3-(2-oxidanylidene-2-pyridin-3-yl-ethyl)quinoxalin-2-yl]-1-pyridin-3-yl-ethanone Openeye Name: 2-[6-nitro-3-[2-oxo-2-(3-pyridyl)ethyl]quinoxalin-2-yl]-1-(3-pyridyl)ethanone CAS Name: 2-[6-nitro-3-[2-oxo-2-(3-pyridinyl)ethyl]-2-quinoxalinyl]-1-(3-pyridinyl)ethanone IUPAC Name: 2-[6-nitro-3-(2-oxo-2-pyridin-3-ylethyl)quinoxalin-2-yl]-1-pyridin-3-ylethanone Traditional Name: 2-[3-[2-keto-2-(3-pyridyl)ethyl]-6-nitro-quinoxalin-2-yl]-1-(3-pyridyl)ethanone Formula: C22H15N5O4 MolecularWeight: 413.3856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])N=C2CC(=O)C4=CN=CC=C4

Isomeric SMILES

C1=CC(=CN=C1)C(=O)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])N=C2CC(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H15N5O4/c28-21(14-3-1-7-23-12-14)10-19-20(11-22(29)15-4-2-8-24-13-15)26-18-9-16(27(30)31)5-6-17(18)25-19/h1-9,12-13H,10-11H2