[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-acetamidobenzoate

Systemtic Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-acetamidobenzoate Openeye Name: [3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid (3-p-cumenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC(=CC=C3)NC(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC(=CC=C3)NC(=O)C

InChI

InChI=1S/C21H21N3O4/c1-13(2)15-7-9-16(10-8-15)20-23-19(28-24-20)12-27-21(26)17-5-4-6-18(11-17)22-14(3)25/h4-11,13H,12H2,1-3H3,(H,22,25)