disodium (2Z,3E)-3-[(4-carboxylatophenyl)methylidene]-1-methoxy-4-oxidanylidene-2-(phenylmethylidene)cyclohexane-1-carboxylate

Systemtic Name: disodium (2Z,3E)-3-[(4-carboxylatophenyl)methylidene]-1-methoxy-4-oxidanylidene-2-(phenylmethylidene)cyclohexane-1-carboxylate Openeye Name: disodium (2Z,3E)-2-benzylidene-3-[(4-carboxylatophenyl)methylene]-1-methoxy-4-oxo-cyclohexanecarboxylate CAS Name: disodium (2Z,3E)-3-[(4-carboxylatophenyl)methylidene]-1-methoxy-4-oxo-2-(phenylmethylene)-1-cyclohexanecarboxylate IUPAC Name: disodium (2Z,3E)-2-benzylidene-3-[(4-carboxylatophenyl)methylidene]-1-methoxy-4-oxocyclohexane-1-carboxylate Traditional Name: disodium (2Z,3E)-2-benzal-3-(4-carboxylatobenzylidene)-4-keto-1-methoxy-cyclohexanecarboxylate Formula: C23H18Na2O6 MolecularWeight: 436.36496

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCC(=O)C(=CC2=CC=C(C=C2)C(=O)[O-])C1=CC3=CC=CC=C3)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

COC\1(CCC(=O)/C(=C/C2=CC=C(C=C2)C(=O)[O-])/C1=C/C3=CC=CC=C3)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C23H20O6.2Na/c1-29-23(22(27)28)12-11-20(24)18(19(23)14-15-5-3-2-4-6-15)13-16-7-9-17(10-8-16)21(25)26;;/h2-10,13-14H,11-12H2,1H3,(H,25,26)(H,27,28);;/q;2*+1/p-2/b18-13+,19-14-;;