(4E)-5-oxidanylidene-4-(5-oxidanylidene-1-phenyl-3-propyl-pyrazol-4-ylidene)-1-propyl-3-pyridin-1-ium-1-yl-pyrrol-2-olate

Systemtic Name: (4E)-5-oxidanylidene-4-(5-oxidanylidene-1-phenyl-3-propyl-pyrazol-4-ylidene)-1-propyl-3-pyridin-1-ium-1-yl-pyrrol-2-olate Openeye Name: (4E)-5-oxo-4-(5-oxo-1-phenyl-3-propyl-pyrazol-4-ylidene)-1-propyl-3-pyridin-1-ium-1-yl-pyrrol-2-olate CAS Name: (4E)-5-oxo-4-(5-oxo-1-phenyl-3-propyl-4-pyrazolylidene)-1-propyl-3-(1-pyridin-1-iumyl)-2-pyrrololate IUPAC Name: (4E)-5-oxo-4-(5-oxo-1-phenyl-3-propylpyrazol-4-ylidene)-1-propyl-3-pyridin-1-ium-1-ylpyrrol-2-olate Traditional Name: (4E)-5-keto-4-(5-keto-1-phenyl-3-propyl-2-pyrazolin-4-ylidene)-1-propyl-3-pyridin-1-ium-1-yl-2-pyrrolin-2-olate Formula: C24H24N4O3 MolecularWeight: 416.47236

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C2C(=C(N(C2=O)CCC)[O-])[N+]3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C/2\C(=C(N(C2=O)CCC)[O-])[N+]3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H24N4O3/c1-3-11-18-19(23(30)28(25-18)17-12-7-5-8-13-17)20-21(26-15-9-6-10-16-26)24(31)27(14-4-2)22(20)29/h5-10,12-13,15-16H,3-4,11,14H2,1-2H3