methyl 4-[3-(4-pentoxyphenyl)-1H-pyrazol-5-yl]benzoate

Systemtic Name: methyl 4-[3-(4-pentoxyphenyl)-1H-pyrazol-5-yl]benzoate Openeye Name: methyl 4-[3-(4-pentoxyphenyl)-1H-pyrazol-5-yl]benzoate CAS Name: 4-[3-(4-pentoxyphenyl)-1H-pyrazol-5-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(4-pentoxyphenyl)-1H-pyrazol-5-yl]benzoate Traditional Name: 4-[3-(4-amoxyphenyl)-1H-pyrazol-5-yl]benzoic acid methyl ester Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=NNC(=C2)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=NNC(=C2)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H24N2O3/c1-3-4-5-14-27-19-12-10-17(11-13-19)21-15-20(23-24-21)16-6-8-18(9-7-16)22(25)26-2/h6-13,15H,3-5,14H2,1-2H3,(H,23,24)