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

Systemtic Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl pyridine-3-carboxylate Openeye Name: [3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]methyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic 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 pyridine-3-carboxylate Traditional Name: nicotinic acid (3-p-cumenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O3/c1-12(2)13-5-7-14(8-6-13)17-20-16(24-21-17)11-23-18(22)15-4-3-9-19-10-15/h3-10,12H,11H2,1-2H3