[6-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]naphthalen-2-yl] 2-methylbutanoate

Systemtic Name: [6-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]naphthalen-2-yl] 2-methylbutanoate Openeye Name: [6-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]-2-naphthyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [6-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]-2-naphthalenyl] ester IUPAC Name: [6-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]naphthalen-2-yl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [6-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]-2-naphthyl] ester Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC1=CC2=C(C=C1)C=C(C=C2)C3=NC(=NO3)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCC(C)C(=O)OC1=CC2=C(C=C1)C=C(C=C2)C3=NC(=NO3)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H28N2O3/c1-6-17(2)26(30)31-23-14-11-19-15-21(8-7-20(19)16-23)25-28-24(29-32-25)18-9-12-22(13-10-18)27(3,4)5/h7-17H,6H2,1-5H3