methyl 4-[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoate

Systemtic Name: methyl 4-[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoate Openeye Name: methyl 4-[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoate CAS Name: 4-[[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoate Traditional Name: 4-[4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoylamino]benzoic acid methyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O5/c1-27-17-7-4-3-6-16(17)20-23-19(29-24-20)9-5-8-18(25)22-15-12-10-14(11-13-15)21(26)28-2/h3-4,6-7,10-13H,5,8-9H2,1-2H3,(H,22,25)