4-[[3-(4-chlorophenyl)-5-oxidanylidene-1,2,4-oxadiazol-4-yl]methyl]benzoic acid

Systemtic Name: 4-[[3-(4-chlorophenyl)-5-oxidanylidene-1,2,4-oxadiazol-4-yl]methyl]benzoic acid Openeye Name: 4-[[3-(4-chlorophenyl)-5-oxo-1,2,4-oxadiazol-4-yl]methyl]benzoic acid CAS Name: 4-[[3-(4-chlorophenyl)-5-oxo-1,2,4-oxadiazol-4-yl]methyl]benzoic acid IUPAC Name: 4-[[3-(4-chlorophenyl)-5-oxo-1,2,4-oxadiazol-4-yl]methyl]benzoic acid Traditional Name: 4-[[3-(4-chlorophenyl)-5-keto-1,2,4-oxadiazol-4-yl]methyl]benzoic acid Formula: C16H11ClN2O4 MolecularWeight: 330.72254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C(=NOC2=O)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CN2C(=NOC2=O)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C16H11ClN2O4/c17-13-7-5-11(6-8-13)14-18-23-16(22)19(14)9-10-1-3-12(4-2-10)15(20)21/h1-8H,9H2,(H,20,21)