(E)-3-(2,5-dimethylpyrazol-3-yl)-1-(2-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(2,5-dimethylpyrazol-3-yl)-1-(2-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-3-(2,5-dimethylpyrazol-3-yl)-1-(2-nitrophenyl)prop-2-en-1-one CAS Name: (E)-3-(2,5-dimethyl-3-pyrazolyl)-1-(2-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-(2,5-dimethylpyrazol-3-yl)-1-(2-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-(2,5-dimethylpyrazol-3-yl)-1-(2-nitrophenyl)prop-2-en-1-one Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C=CC(=O)C2=CC=CC=C2[N+](=O)[O-])C

Isomeric SMILES

CC1=NN(C(=C1)/C=C/C(=O)C2=CC=CC=C2[N+](=O)[O-])C

InChI

InChI=1S/C14H13N3O3/c1-10-9-11(16(2)15-10)7-8-14(18)12-5-3-4-6-13(12)17(19)20/h3-9H,1-2H3/b8-7+