5-[(2-ethylimidazol-1-yl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione

Systemtic Name: 5-[(2-ethylimidazol-1-yl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione Openeye Name: 5-[(2-ethylimidazol-1-yl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione CAS Name: 5-[(2-ethyl-1-imidazolyl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: 5-[(2-ethylimidazol-1-yl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione Traditional Name: 5-[(2-ethylimidazol-1-yl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-quinone Formula: C14H13N5O4 MolecularWeight: 315.28412

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CN1CC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-]

Isomeric SMILES

CCC1=NC=CN1CC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C14H13N5O4/c1-2-11-15-3-4-18(11)7-8-5-9(19(22)23)6-10-12(8)17-14(21)13(20)16-10/h3-6H,2,7H2,1H3,(H,16,20)(H,17,21)