(E)-3-[5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]furan-2-yl]-1-(2-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]furan-2-yl]-1-(2-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-3-[5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-2-furyl]-1-(2-nitrophenyl)prop-2-en-1-one CAS Name: (E)-3-[5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-2-furanyl]-1-(2-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-[5-[(4-bromo-3-nitropyrazol-1-yl)methyl]furan-2-yl]-1-(2-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-[5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-2-furyl]-1-(2-nitrophenyl)prop-2-en-1-one Formula: C17H11BrN4O6 MolecularWeight: 447.19644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)C=CC2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)/C=C/C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C17H11BrN4O6/c18-14-10-20(19-17(14)22(26)27)9-12-6-5-11(28-12)7-8-16(23)13-3-1-2-4-15(13)21(24)25/h1-8,10H,9H2/b8-7+