3-[(4Z)-4-[[2-(4-methoxyphenoxy)phenyl]methylidene]-5-oxidanylidene-3-propan-2-yl-pyrazol-1-yl]benzoic acid

Systemtic Name: 3-[(4Z)-4-[[2-(4-methoxyphenoxy)phenyl]methylidene]-5-oxidanylidene-3-propan-2-yl-pyrazol-1-yl]benzoic acid Openeye Name: 3-[(4Z)-3-isopropyl-4-[[2-(4-methoxyphenoxy)phenyl]methylene]-5-oxo-pyrazol-1-yl]benzoic acid CAS Name: 3-[(4Z)-4-[[2-(4-methoxyphenoxy)phenyl]methylidene]-5-oxo-3-propan-2-yl-1-pyrazolyl]benzoic acid IUPAC Name: 3-[(4Z)-4-[[2-(4-methoxyphenoxy)phenyl]methylidene]-5-oxo-3-propan-2-ylpyrazol-1-yl]benzoic acid Traditional Name: 3-[(4Z)-3-isopropyl-5-keto-4-[2-(4-methoxyphenoxy)benzylidene]-2-pyrazolin-1-yl]benzoic acid Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=O)C1=CC2=CC=CC=C2OC3=CC=C(C=C3)OC)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CC(C)C\1=NN(C(=O)/C1=C\C2=CC=CC=C2OC3=CC=C(C=C3)OC)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C27H24N2O5/c1-17(2)25-23(26(30)29(28-25)20-9-6-8-19(15-20)27(31)32)16-18-7-4-5-10-24(18)34-22-13-11-21(33-3)12-14-22/h4-17H,1-3H3,(H,31,32)/b23-16-