(1,3-diphenylpyrazol-4-yl)methyl 4-phenoxybutanoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 4-phenoxybutanoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 4-phenoxybutanoate CAS Name: 4-phenoxybutanoic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 4-phenoxybutanoate Traditional Name: 4-phenoxybutyric acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2COC(=O)CCCOC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2COC(=O)CCCOC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H24N2O3/c29-25(17-10-18-30-24-15-8-3-9-16-24)31-20-22-19-28(23-13-6-2-7-14-23)27-26(22)21-11-4-1-5-12-21/h1-9,11-16,19H,10,17-18,20H2