1-[(2S,3R)-4-ethanoyl-2,3-dimethyl-6-nitro-2,3-dihydroquinoxalin-1-yl]ethanone

Systemtic Name: 1-[(2S,3R)-4-ethanoyl-2,3-dimethyl-6-nitro-2,3-dihydroquinoxalin-1-yl]ethanone Openeye Name: 1-[(2S,3R)-4-acetyl-2,3-dimethyl-6-nitro-2,3-dihydroquinoxalin-1-yl]ethanone CAS Name: 1-[(2S,3R)-4-acetyl-2,3-dimethyl-6-nitro-2,3-dihydroquinoxalin-1-yl]ethanone IUPAC Name: 1-[(2S,3R)-4-acetyl-2,3-dimethyl-6-nitro-2,3-dihydroquinoxalin-1-yl]ethanone Traditional Name: 1-[(2S,3R)-4-acetyl-2,3-dimethyl-6-nitro-2,3-dihydroquinoxalin-1-yl]ethanone Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(C2=C(N1C(=O)C)C=CC(=C2)[N+](=O)[O-])C(=O)C)C

Isomeric SMILES

C[C@H]1[C@H](N(C2=C(N1C(=O)C)C=CC(=C2)[N+](=O)[O-])C(=O)C)C

InChI

InChI=1S/C14H17N3O4/c1-8-9(2)16(11(4)19)14-7-12(17(20)21)5-6-13(14)15(8)10(3)18/h5-9H,1-4H3/t8-,9+/m0/s1