3-[(4Z)-4-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]-3-methylidene-5-oxidanylidene-pyrazolidin-1-yl]benzoate

Systemtic Name: 3-[(4Z)-4-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]-3-methylidene-5-oxidanylidene-pyrazolidin-1-yl]benzoate Openeye Name: 3-[(4Z)-4-[(4-allyloxy-3-methoxy-phenyl)methylene]-3-methylene-5-oxo-pyrazolidin-1-yl]benzoate CAS Name: 3-[(4Z)-4-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-3-methylene-5-oxo-1-pyrazolidinyl]benzoate IUPAC Name: 3-[(4Z)-4-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-3-methylidene-5-oxopyrazolidin-1-yl]benzoate Traditional Name: 3-[(4Z)-4-(4-allyloxy-3-methoxy-benzylidene)-5-keto-3-methylene-pyrazolidin-1-yl]benzoate Formula: C22H19N2O5- MolecularWeight: 391.39666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=C)NN(C2=O)C3=CC=CC(=C3)C(=O)[O-])OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C\2/C(=C)NN(C2=O)C3=CC=CC(=C3)C(=O)[O-])OCC=C

InChI

InChI=1S/C22H20N2O5/c1-4-10-29-19-9-8-15(12-20(19)28-3)11-18-14(2)23-24(21(18)25)17-7-5-6-16(13-17)22(26)27/h4-9,11-13,23H,1-2,10H2,3H3,(H,26,27)/p-1/b18-11-