5-methyl-4-[(1R)-2-nitro-1-phenyl-ethyl]-2-phenyl-pyrazol-3-olate

Systemtic Name: 5-methyl-4-[(1R)-2-nitro-1-phenyl-ethyl]-2-phenyl-pyrazol-3-olate Openeye Name: 5-methyl-4-[(1R)-2-nitro-1-phenyl-ethyl]-2-phenyl-pyrazol-3-olate CAS Name: 5-methyl-4-[(1R)-2-nitro-1-phenylethyl]-2-phenyl-3-pyrazololate IUPAC Name: 5-methyl-4-[(1R)-2-nitro-1-phenylethyl]-2-phenylpyrazol-3-olate Traditional Name: 5-methyl-4-[(1R)-2-nitro-1-phenyl-ethyl]-2-phenyl-pyrazol-3-olate Formula: C18H16N3O3- MolecularWeight: 322.33794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(C[N+](=O)[O-])C2=CC=CC=C2)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1[C@H](C[N+](=O)[O-])C2=CC=CC=C2)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3/c1-13-17(16(12-20(23)24)14-8-4-2-5-9-14)18(22)21(19-13)15-10-6-3-7-11-15/h2-11,16,22H,12H2,1H3/p-1/t16-/m1/s1