ethyl 4-[3-(1-phenylpyrazol-4-yl)propanoyloxy]benzoate

Systemtic Name: ethyl 4-[3-(1-phenylpyrazol-4-yl)propanoyloxy]benzoate Openeye Name: ethyl 4-[3-(1-phenylpyrazol-4-yl)propanoyloxy]benzoate CAS Name: 4-[1-oxo-3-(1-phenyl-4-pyrazolyl)propoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(1-phenylpyrazol-4-yl)propanoyloxy]benzoate Traditional Name: 4-[3-(1-phenylpyrazol-4-yl)propanoyloxy]benzoic acid ethyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O4/c1-2-26-21(25)17-9-11-19(12-10-17)27-20(24)13-8-16-14-22-23(15-16)18-6-4-3-5-7-18/h3-7,9-12,14-15H,2,8,13H2,1H3