3-methoxy-5-methyl-4-nitro-1-[(E)-3-phenylprop-2-enyl]pyrazole

Systemtic Name: 3-methoxy-5-methyl-4-nitro-1-[(E)-3-phenylprop-2-enyl]pyrazole Openeye Name: 1-[(E)-cinnamyl]-3-methoxy-5-methyl-4-nitro-pyrazole CAS Name: 3-methoxy-5-methyl-4-nitro-1-[(E)-3-phenylprop-2-enyl]pyrazole IUPAC Name: 3-methoxy-5-methyl-4-nitro-1-[(E)-3-phenylprop-2-enyl]pyrazole Traditional Name: 1-[(E)-cinnamyl]-3-methoxy-5-methyl-4-nitro-pyrazole Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC=CC2=CC=CC=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C/C=C/C2=CC=CC=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O3/c1-11-13(17(18)19)14(20-2)15-16(11)10-6-9-12-7-4-3-5-8-12/h3-9H,10H2,1-2H3/b9-6+