propan-2-yl 4-[(4E)-4-[(E)-3-(furan-2-yl)prop-2-enylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoate

Systemtic Name: propan-2-yl 4-[(4E)-4-[(E)-3-(furan-2-yl)prop-2-enylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoate Openeye Name: isopropyl 4-[(4E)-4-[(E)-3-(2-furyl)prop-2-enylidene]-3-methyl-5-oxo-pyrazol-1-yl]benzoate CAS Name: 4-[(4E)-4-[(E)-3-(2-furanyl)prop-2-enylidene]-3-methyl-5-oxo-1-pyrazolyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(4E)-4-[(E)-3-(furan-2-yl)prop-2-enylidene]-3-methyl-5-oxopyrazol-1-yl]benzoate Traditional Name: 4-[(4E)-4-[(E)-3-(2-furyl)prop-2-enylidene]-5-keto-3-methyl-2-pyrazolin-1-yl]benzoic acid isopropyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC=CC2=CC=CO2)C3=CC=C(C=C3)C(=O)OC(C)C

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C=C/C2=CC=CO2)C3=CC=C(C=C3)C(=O)OC(C)C

InChI

InChI=1S/C21H20N2O4/c1-14(2)27-21(25)16-9-11-17(12-10-16)23-20(24)19(15(3)22-23)8-4-6-18-7-5-13-26-18/h4-14H,1-3H3/b6-4+,19-8+