(E)-3-[4-methoxy-3-[(3-nitropyrazol-1-yl)methyl]phenyl]-1-(2-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[4-methoxy-3-[(3-nitropyrazol-1-yl)methyl]phenyl]-1-(2-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-3-[4-methoxy-3-[(3-nitropyrazol-1-yl)methyl]phenyl]-1-(2-nitrophenyl)prop-2-en-1-one CAS Name: (E)-3-[4-methoxy-3-[(3-nitro-1-pyrazolyl)methyl]phenyl]-1-(2-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-[4-methoxy-3-[(3-nitropyrazol-1-yl)methyl]phenyl]-1-(2-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-[4-methoxy-3-[(3-nitropyrazol-1-yl)methyl]phenyl]-1-(2-nitrophenyl)prop-2-en-1-one Formula: C20H16N4O6 MolecularWeight: 408.36424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=CC=C2[N+](=O)[O-])CN3C=CC(=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=CC=C2[N+](=O)[O-])CN3C=CC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O6/c1-30-19-9-7-14(12-15(19)13-22-11-10-20(21-22)24(28)29)6-8-18(25)16-4-2-3-5-17(16)23(26)27/h2-12H,13H2,1H3/b8-6+