(E)-1-(4-methylphenyl)-3-[5-[(4-nitropyrazol-1-yl)methyl]furan-2-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-methylphenyl)-3-[5-[(4-nitropyrazol-1-yl)methyl]furan-2-yl]prop-2-en-1-one Openeye Name: (E)-3-[5-[(4-nitropyrazol-1-yl)methyl]-2-furyl]-1-(p-tolyl)prop-2-en-1-one CAS Name: (E)-1-(4-methylphenyl)-3-[5-[(4-nitro-1-pyrazolyl)methyl]-2-furanyl]-2-propen-1-one IUPAC Name: (E)-1-(4-methylphenyl)-3-[5-[(4-nitropyrazol-1-yl)methyl]furan-2-yl]prop-2-en-1-one Traditional Name: (E)-3-[5-[(4-nitropyrazol-1-yl)methyl]-2-furyl]-1-(p-tolyl)prop-2-en-1-one Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CC2=CC=C(O2)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(O2)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O4/c1-13-2-4-14(5-3-13)18(22)9-8-16-6-7-17(25-16)12-20-11-15(10-19-20)21(23)24/h2-11H,12H2,1H3/b9-8+