4-[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoic acid

Systemtic Name: 4-[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoic acid Openeye Name: 4-[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoic acid CAS Name: 4-[[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-oxobutyl]amino]benzoic acid IUPAC Name: 4-[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoic acid Traditional Name: 4-[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoic acid Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=N2)CCCC(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=N2)CCCC(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H19N3O5/c1-27-16-6-3-2-5-15(16)19-22-18(28-23-19)8-4-7-17(24)21-14-11-9-13(10-12-14)20(25)26/h2-3,5-6,9-12H,4,7-8H2,1H3,(H,21,24)(H,25,26)