sodium 2-[3-[(Z)-(5-oxidanylidene-3,4-diphenyl-pyrrol-2-ylidene)methyl]phenoxy]ethanoate

Systemtic Name: sodium 2-[3-[(Z)-(5-oxidanylidene-3,4-diphenyl-pyrrol-2-ylidene)methyl]phenoxy]ethanoate Openeye Name: sodium 2-[3-[(Z)-(5-oxo-3,4-diphenyl-pyrrol-2-ylidene)methyl]phenoxy]acetate CAS Name: sodium 2-[3-[(Z)-(5-oxo-3,4-diphenyl-2-pyrrolylidene)methyl]phenoxy]acetate IUPAC Name: sodium 2-[3-[(Z)-(5-oxo-3,4-diphenylpyrrol-2-ylidene)methyl]phenoxy]acetate Traditional Name: sodium 2-[3-[(Z)-(5-keto-3,4-diphenyl-3-pyrrolin-2-ylidene)methyl]phenoxy]acetate Formula: C25H18NNaO4 MolecularWeight: 419.40449

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)NC2=CC3=CC(=CC=C3)OCC(=O)[O-])C4=CC=CC=C4.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C\2=C(C(=O)N/C2=C\C3=CC(=CC=C3)OCC(=O)[O-])C4=CC=CC=C4.[Na+]

InChI

InChI=1S/C25H19NO4.Na/c27-22(28)16-30-20-13-7-8-17(14-20)15-21-23(18-9-3-1-4-10-18)24(25(29)26-21)19-11-5-2-6-12-19;/h1-15H,16H2,(H,26,29)(H,27,28);/q;+1/p-1/b21-15-;