(E)-1-cyclopropyl-3-[5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]furan-2-yl]prop-2-en-1-one

Systemtic Name: (E)-1-cyclopropyl-3-[5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]furan-2-yl]prop-2-en-1-one Openeye Name: (E)-1-cyclopropyl-3-[5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-2-furyl]prop-2-en-1-one CAS Name: (E)-1-cyclopropyl-3-[5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-2-furanyl]-2-propen-1-one IUPAC Name: (E)-1-cyclopropyl-3-[5-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]furan-2-yl]prop-2-en-1-one Traditional Name: (E)-1-cyclopropyl-3-[5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-2-furyl]prop-2-en-1-one Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C=CC(=O)C3CC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)/C=C/C(=O)C3CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O4/c1-10-16(19(21)22)11(2)18(17-10)9-14-6-5-13(23-14)7-8-15(20)12-3-4-12/h5-8,12H,3-4,9H2,1-2H3/b8-7+