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

Systemtic Name: (E)-3-(2-chloranyl-5-nitro-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-3-(2-chloro-5-nitro-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-3-(2-chloro-5-nitrophenyl)-1-(1,3,5-trimethyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(2-chloro-5-nitrophenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-3-(2-chloro-5-nitro-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Formula: C15H14ClN3O3 MolecularWeight: 319.74296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)C=CC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C15H14ClN3O3/c1-9-15(10(2)18(3)17-9)14(20)7-4-11-8-12(19(21)22)5-6-13(11)16/h4-8H,1-3H3/b7-4+