(E)-1-(4-bromanyl-2-ethyl-pyrazol-3-yl)-3-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-bromanyl-2-ethyl-pyrazol-3-yl)-3-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-bromo-2-ethyl-pyrazol-3-yl)-3-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-bromo-2-ethyl-3-pyrazolyl)-3-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-bromo-2-ethylpyrazol-3-yl)-3-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-bromo-2-ethyl-pyrazol-3-yl)-3-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]prop-2-en-1-one Formula: C23H22BrN3O5 MolecularWeight: 500.34188

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)C=CC2=CC(=C(C=C2)OC)COC3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)/C=C/C2=CC(=C(C=C2)OC)COC3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C23H22BrN3O5/c1-4-26-23(19(24)13-25-26)21(28)9-5-16-6-10-22(31-3)17(12-16)14-32-18-7-8-20(27(29)30)15(2)11-18/h5-13H,4,14H2,1-3H3/b9-5+