(2E,4E)-1-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)hexa-2,4-dien-1-one

Systemtic Name: (2E,4E)-1-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)hexa-2,4-dien-1-one Openeye Name: (2E,4E)-1-(4-bromo-3,5-dimethyl-pyrazol-1-yl)hexa-2,4-dien-1-one CAS Name: (2E,4E)-1-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-hexa-2,4-dienone IUPAC Name: (2E,4E)-1-(4-bromo-3,5-dimethylpyrazol-1-yl)hexa-2,4-dien-1-one Traditional Name: (2E,4E)-1-(4-bromo-3,5-dimethyl-pyrazol-1-yl)hexa-2,4-dien-1-one Formula: C11H13BrN2O MolecularWeight: 269.13772

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)N1C(=C(C(=N1)C)Br)C

Isomeric SMILES

C/C=C/C=C/C(=O)N1C(=C(C(=N1)C)Br)C

InChI

InChI=1S/C11H13BrN2O/c1-4-5-6-7-10(15)14-9(3)11(12)8(2)13-14/h4-7H,1-3H3/b5-4+,7-6+