(E)-3-(1,5-dimethylpyrazol-4-yl)-2-nitro-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(1,5-dimethylpyrazol-4-yl)-2-nitro-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(1,5-dimethylpyrazol-4-yl)-2-nitro-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-(1,5-dimethyl-4-pyrazolyl)-2-nitro-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(1,5-dimethylpyrazol-4-yl)-2-nitro-1-phenylprop-2-en-1-one Traditional Name: (E)-3-(1,5-dimethylpyrazol-4-yl)-2-nitro-1-phenyl-prop-2-en-1-one Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C=C(C(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C)/C=C(\C(=O)C2=CC=CC=C2)/[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O3/c1-10-12(9-15-16(10)2)8-13(17(19)20)14(18)11-6-4-3-5-7-11/h3-9H,1-2H3/b13-8+