4-[(4Z)-4-[(3-ethoxy-4-oxidanyl-phenyl)methylidene]-3-methylidene-5-oxidanylidene-pyrazolidin-1-yl]benzoic acid

Systemtic Name: 4-[(4Z)-4-[(3-ethoxy-4-oxidanyl-phenyl)methylidene]-3-methylidene-5-oxidanylidene-pyrazolidin-1-yl]benzoic acid Openeye Name: 4-[(4Z)-4-[(3-ethoxy-4-hydroxy-phenyl)methylene]-3-methylene-5-oxo-pyrazolidin-1-yl]benzoic acid CAS Name: 4-[(4Z)-4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-methylene-5-oxo-1-pyrazolidinyl]benzoic acid IUPAC Name: 4-[(4Z)-4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-methylidene-5-oxopyrazolidin-1-yl]benzoic acid Traditional Name: 4-[(4Z)-4-(3-ethoxy-4-hydroxy-benzylidene)-5-keto-3-methylene-pyrazolidin-1-yl]benzoic acid Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=C)NN(C2=O)C3=CC=C(C=C3)C(=O)O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C\2/C(=C)NN(C2=O)C3=CC=C(C=C3)C(=O)O)O

InChI

InChI=1S/C20H18N2O5/c1-3-27-18-11-13(4-9-17(18)23)10-16-12(2)21-22(19(16)24)15-7-5-14(6-8-15)20(25)26/h4-11,21,23H,2-3H2,1H3,(H,25,26)/b16-10-