methyl 4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoyloxy]benzoate

Systemtic Name: methyl 4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoyloxy]benzoate Openeye Name: methyl 4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoyloxy]benzoate CAS Name: 4-[3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxopropoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(3,5-dimethyl-1-phenylpyrazol-4-yl)propanoyloxy]benzoate Traditional Name: 4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoyloxy]benzoic acid methyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)OC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)OC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H22N2O4/c1-15-20(16(2)24(23-15)18-7-5-4-6-8-18)13-14-21(25)28-19-11-9-17(10-12-19)22(26)27-3/h4-12H,13-14H2,1-3H3