(E)-3-[azanyl-(2-nitrophenyl)methyl]-4-oxidanyl-pent-3-en-2-one

Systemtic Name: (E)-3-[azanyl-(2-nitrophenyl)methyl]-4-oxidanyl-pent-3-en-2-one Openeye Name: (E)-3-[amino-(2-nitrophenyl)methyl]-4-hydroxy-pent-3-en-2-one CAS Name: (E)-3-[amino-(2-nitrophenyl)methyl]-4-hydroxy-3-penten-2-one IUPAC Name: (E)-3-[amino-(2-nitrophenyl)methyl]-4-hydroxypent-3-en-2-one Traditional Name: (E)-3-[amino-(2-nitrophenyl)methyl]-4-hydroxy-pent-3-en-2-one Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(C1=CC=CC=C1[N+](=O)[O-])N)C(=O)C)O

Isomeric SMILES

C/C(=C(/C(C1=CC=CC=C1[N+](=O)[O-])N)\C(=O)C)/O

InChI

InChI=1S/C12H14N2O4/c1-7(15)11(8(2)16)12(13)9-5-3-4-6-10(9)14(17)18/h3-6,12,15H,13H2,1-2H3/b11-7-