methyl 3-azanyl-4-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]benzoate

Systemtic Name: methyl 3-azanyl-4-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]benzoate Openeye Name: methyl 3-amino-4-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]benzoate CAS Name: 3-amino-4-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid methyl ester IUPAC Name: methyl 3-amino-4-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]benzoate Traditional Name: 3-amino-4-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid methyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NOC(=N2)C3=C(C=C(C=C3)C(=O)OC)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NOC(=N2)C3=C(C=C(C=C3)C(=O)OC)N

InChI

InChI=1S/C20H21N3O3/c1-20(2,3)14-8-5-12(6-9-14)17-22-18(26-23-17)15-10-7-13(11-16(15)21)19(24)25-4/h5-11H,21H2,1-4H3