(5E)-5-[[(4S)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]methylidene]-4,6-bis(oxidanylidene)-1-phenyl-pyrimidin-2-olate

Systemtic Name: (5E)-5-[[(4S)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]methylidene]-4,6-bis(oxidanylidene)-1-phenyl-pyrimidin-2-olate Openeye Name: (5E)-5-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylene]-4,6-dioxo-1-phenyl-pyrimidin-2-olate CAS Name: (5E)-5-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylidene]-4,6-dioxo-1-phenyl-2-pyrimidinolate IUPAC Name: (5E)-5-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylidene]-4,6-dioxo-1-phenylpyrimidin-2-olate Traditional Name: (5E)-4,6-diketo-5-[[(4S)-5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl]methylene]-1-phenyl-pyrimidin-2-olate Formula: C21H15N4O4- MolecularWeight: 387.3682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C=C2C(=O)N=C(N(C2=O)C3=CC=CC=C3)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)[C@H]1/C=C/2\C(=O)N=C(N(C2=O)C3=CC=CC=C3)[O-])C4=CC=CC=C4

InChI

InChI=1S/C21H16N4O4/c1-13-16(20(28)25(23-13)15-10-6-3-7-11-15)12-17-18(26)22-21(29)24(19(17)27)14-8-4-2-5-9-14/h2-12,16H,1H3,(H,22,26,29)/p-1/b17-12+/t16-/m0/s1