4-[3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]benzoic acid

Systemtic Name: 4-[3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]benzoic acid Openeye Name: 4-[3-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]propanoylamino]benzoic acid CAS Name: 4-[[3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-[3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]benzoic acid Traditional Name: 4-[3-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]propanoylamino]benzoic acid Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H17N3O4/c1-12-2-4-13(5-3-12)18-21-17(26-22-18)11-10-16(23)20-15-8-6-14(7-9-15)19(24)25/h2-9H,10-11H2,1H3,(H,20,23)(H,24,25)