methyl 2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]benzoate hydrochloride

Systemtic Name: methyl 2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]benzoate hydrochloride Openeye Name: methyl 2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]benzoate hydrochloride CAS Name: 2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]benzoic acid methyl ester hydrochloride IUPAC Name: methyl 2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]benzoate hydrochloride Traditional Name: 2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]benzoic acid methyl ester hydrochloride Formula: C18H17ClN2O3 MolecularWeight: 344.79218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=C2)C3=CC=CC=C3C(=O)OC.Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=C2)C3=CC=CC=C3C(=O)OC.Cl

InChI

InChI=1S/C18H16N2O3.ClH/c1-22-13-9-7-12(8-10-13)16-11-17(20-19-16)14-5-3-4-6-15(14)18(21)23-2;/h3-11H,1-2H3,(H,19,20);1H