1-(2-methyl-5,7-dinitro-quinolin-3-yl)ethanone

Systemtic Name: 1-(2-methyl-5,7-dinitro-quinolin-3-yl)ethanone Openeye Name: 1-(2-methyl-5,7-dinitro-3-quinolyl)ethanone CAS Name: 1-(2-methyl-5,7-dinitro-3-quinolinyl)ethanone IUPAC Name: 1-(2-methyl-5,7-dinitroquinolin-3-yl)ethanone Traditional Name: 1-(2-methyl-5,7-dinitro-3-quinolyl)ethanone Formula: C12H9N3O5 MolecularWeight: 275.21696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=CC2=N1)[N+](=O)[O-])[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=CC2=N1)[N+](=O)[O-])[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C12H9N3O5/c1-6-9(7(2)16)5-10-11(13-6)3-8(14(17)18)4-12(10)15(19)20/h3-5H,1-2H3