methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoate

Systemtic Name: methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoate Openeye Name: methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoate CAS Name: 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoate Traditional Name: 4-[3-(4-chlorophenyl)-2-pyrazolin-1-yl]benzoic acid methyl ester Formula: C17H15ClN2O2 MolecularWeight: 314.7662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H15ClN2O2/c1-22-17(21)13-4-8-15(9-5-13)20-11-10-16(19-20)12-2-6-14(18)7-3-12/h2-9H,10-11H2,1H3