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

Systemtic Name: 3-[4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoic acid Openeye Name: 3-[4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoic acid CAS Name: 3-[[4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-oxobutyl]amino]benzoic acid IUPAC Name: 3-[4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoic acid Traditional Name: 3-[4-[3-(4-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=C(C=C1)C2=NOC(=N2)CCCC(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)CCCC(=O)NC3=CC=CC(=C3)C(=O)O

InChI

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