3-(bromomethyl)-7-nitro-3-(2-oxidanylidenepropyl)-1,4-dihydroquinoxalin-2-one

Systemtic Name: 3-(bromomethyl)-7-nitro-3-(2-oxidanylidenepropyl)-1,4-dihydroquinoxalin-2-one Openeye Name: 3-acetonyl-3-(bromomethyl)-7-nitro-1,4-dihydroquinoxalin-2-one CAS Name: 3-(bromomethyl)-7-nitro-3-(2-oxopropyl)-1,4-dihydroquinoxalin-2-one IUPAC Name: 3-(bromomethyl)-7-nitro-3-(2-oxopropyl)-1,4-dihydroquinoxalin-2-one Traditional Name: 3-acetonyl-3-(bromomethyl)-7-nitro-1,4-dihydroquinoxalin-2-one Formula: C12H12BrN3O4 MolecularWeight: 342.14538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1(C(=O)NC2=C(N1)C=CC(=C2)[N+](=O)[O-])CBr

Isomeric SMILES

CC(=O)CC1(C(=O)NC2=C(N1)C=CC(=C2)[N+](=O)[O-])CBr

InChI

InChI=1S/C12H12BrN3O4/c1-7(17)5-12(6-13)11(18)14-10-4-8(16(19)20)2-3-9(10)15-12/h2-4,15H,5-6H2,1H3,(H,14,18)