(1,3-diphenylpyrazol-4-yl)methyl 4-chloranyl-2-oxidanyl-benzoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 4-chloranyl-2-oxidanyl-benzoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 4-chloro-2-hydroxy-benzoate CAS Name: 4-chloro-2-hydroxybenzoic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 4-chloro-2-hydroxybenzoate Traditional Name: 4-chloro-2-hydroxy-benzoic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C23H17ClN2O3 MolecularWeight: 404.84568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17ClN2O3/c24-18-11-12-20(21(27)13-18)23(28)29-15-17-14-26(19-9-5-2-6-10-19)25-22(17)16-7-3-1-4-8-16/h1-14,27H,15H2