ethyl 4-[3,5-bis(oxidanylidene)-4-[(2-propoxyphenyl)methylidene]pyrazolidin-1-yl]benzoate

Systemtic Name: ethyl 4-[3,5-bis(oxidanylidene)-4-[(2-propoxyphenyl)methylidene]pyrazolidin-1-yl]benzoate Openeye Name: ethyl 4-[3,5-dioxo-4-[(2-propoxyphenyl)methylene]pyrazolidin-1-yl]benzoate CAS Name: 4-[3,5-dioxo-4-[(2-propoxyphenyl)methylidene]-1-pyrazolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3,5-dioxo-4-[(2-propoxyphenyl)methylidene]pyrazolidin-1-yl]benzoate Traditional Name: 4-[3,5-diketo-4-(2-propoxybenzylidene)pyrazolidin-1-yl]benzoic acid ethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCCOC1=CC=CC=C1C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C22H22N2O5/c1-3-13-29-19-8-6-5-7-16(19)14-18-20(25)23-24(21(18)26)17-11-9-15(10-12-17)22(27)28-4-2/h5-12,14H,3-4,13H2,1-2H3,(H,23,25)