4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]butanoate

Systemtic Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]butanoate Openeye Name: 4-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]butanoate CAS Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]butanoate IUPAC Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]butanoate Traditional Name: 4-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]butyrate Formula: C13H13N2O3- MolecularWeight: 245.25392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)CCCC(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)CCCC(=O)[O-]

InChI

InChI=1S/C13H14N2O3/c1-9-4-2-5-10(8-9)13-14-11(18-15-13)6-3-7-12(16)17/h2,4-5,8H,3,6-7H2,1H3,(H,16,17)/p-1