(4-nitrophenyl)-(3,4,5-trimethylpyrazol-1-yl)methanone

Systemtic Name: (4-nitrophenyl)-(3,4,5-trimethylpyrazol-1-yl)methanone Openeye Name: (4-nitrophenyl)-(3,4,5-trimethylpyrazol-1-yl)methanone CAS Name: (4-nitrophenyl)-(3,4,5-trimethyl-1-pyrazolyl)methanone IUPAC Name: (4-nitrophenyl)-(3,4,5-trimethylpyrazol-1-yl)methanone Traditional Name: (4-nitrophenyl)-(3,4,5-trimethylpyrazol-1-yl)methanone Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(N(N=C1C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C13H13N3O3/c1-8-9(2)14-15(10(8)3)13(17)11-4-6-12(7-5-11)16(18)19/h4-7H,1-3H3