1-(1,3-benzoxazol-2-yl)-5-(4-chlorophenyl)pyrazole-3-carboxylate

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-5-(4-chlorophenyl)pyrazole-3-carboxylate Openeye Name: 1-(1,3-benzoxazol-2-yl)-5-(4-chlorophenyl)pyrazole-3-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-5-(4-chlorophenyl)-3-pyrazolecarboxylate IUPAC Name: 1-(1,3-benzoxazol-2-yl)-5-(4-chlorophenyl)pyrazole-3-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)-5-(4-chlorophenyl)pyrazole-3-carboxylate Formula: C17H9ClN3O3- MolecularWeight: 338.72466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)N3C(=CC(=N3)C(=O)[O-])C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)N3C(=CC(=N3)C(=O)[O-])C4=CC=C(C=C4)Cl

InChI

InChI=1S/C17H10ClN3O3/c18-11-7-5-10(6-8-11)14-9-13(16(22)23)20-21(14)17-19-12-3-1-2-4-15(12)24-17/h1-9H,(H,22,23)/p-1