(4-pyrazol-1-ylphenyl)methyl 3-oxidanylbenzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 3-oxidanylbenzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 3-hydroxybenzoate CAS Name: 3-hydroxybenzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 3-hydroxybenzoate Traditional Name: 3-hydroxybenzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C17H14N2O3 MolecularWeight: 294.30466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)O)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C17H14N2O3/c20-16-4-1-3-14(11-16)17(21)22-12-13-5-7-15(8-6-13)19-10-2-9-18-19/h1-11,20H,12H2