(E)-3-(2-chloranyl-5-nitro-phenyl)-1-(1-methylpyrazol-3-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(2-chloranyl-5-nitro-phenyl)-1-(1-methylpyrazol-3-yl)prop-2-en-1-one Openeye Name: (E)-3-(2-chloro-5-nitro-phenyl)-1-(1-methylpyrazol-3-yl)prop-2-en-1-one CAS Name: (E)-3-(2-chloro-5-nitrophenyl)-1-(1-methyl-3-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(2-chloro-5-nitrophenyl)-1-(1-methylpyrazol-3-yl)prop-2-en-1-one Traditional Name: (E)-3-(2-chloro-5-nitro-phenyl)-1-(1-methylpyrazol-3-yl)prop-2-en-1-one Formula: C13H10ClN3O3 MolecularWeight: 291.6898

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)C=CC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN1C=CC(=N1)C(=O)/C=C/C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H10ClN3O3/c1-16-7-6-12(15-16)13(18)5-2-9-8-10(17(19)20)3-4-11(9)14/h2-8H,1H3/b5-2+