[3-phenyl-1-[2-(4-phenylmethoxyphenyl)ethyl]pyrazol-4-yl] butanoate

Systemtic Name: [3-phenyl-1-[2-(4-phenylmethoxyphenyl)ethyl]pyrazol-4-yl] butanoate Openeye Name: [1-[2-(4-benzyloxyphenyl)ethyl]-3-phenyl-pyrazol-4-yl] butanoate CAS Name: butanoic acid [3-phenyl-1-[2-(4-phenylmethoxyphenyl)ethyl]-4-pyrazolyl] ester IUPAC Name: [3-phenyl-1-[2-(4-phenylmethoxyphenyl)ethyl]pyrazol-4-yl] butanoate Traditional Name: butyric acid [1-[2-(4-benzoxyphenyl)ethyl]-3-phenyl-pyrazol-4-yl] ester Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CN(N=C1C2=CC=CC=C2)CCC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCC(=O)OC1=CN(N=C1C2=CC=CC=C2)CCC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O3/c1-2-9-27(31)33-26-20-30(29-28(26)24-12-7-4-8-13-24)19-18-22-14-16-25(17-15-22)32-21-23-10-5-3-6-11-23/h3-8,10-17,20H,2,9,18-19,21H2,1H3