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calcium [6-[3-(trifluoromethyl)phenyl]iminocyclohexa-2,4-dien-1-ylidene]methanediolate

calcium [6-[3-(trifluoromethyl)phenyl]iminocyclohexa-2,4-dien-1-ylidene]methanediolate

Systemtic Name:calcium [6-[3-(trifluoromethyl)phenyl]iminocyclohexa-2,4-dien-1-ylidene]methanediolate
Openeye Name:calcium [6-[3-(trifluoromethyl)phenyl]iminocyclohexa-2,4-dien-1-ylidene]methanediolate
CAS Name:calcium [6-[3-(trifluoromethyl)phenyl]imino-1-cyclohexa-2,4-dienylidene]methanediolate
IUPAC Name:calcium [6-[3-(trifluoromethyl)phenyl]iminocyclohexa-2,4-dien-1-ylidene]methanediolate
Traditional Name:calcium [6-[3-(trifluoromethyl)phenyl]iminocyclohexa-2,4-dien-1-ylidene]methanediolate
Formula: C14H8CaF3NO2
MolecularWeight: 319.29203
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C([O-])[O-])C(=NC2=CC=CC(=C2)C(F)(F)F)C=C1.[Ca+2]


Isomeric SMILES

C1=CC(=C([O-])[O-])C(=NC2=CC=CC(=C2)C(F)(F)F)C=C1.[Ca+2]


InChI

InChI=1S/C14H10F3NO2.Ca/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20;/h1-8,19-20H;/q;+2/p-2


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