(3,5,6-trimethylpyrazin-2-yl)methyl 2-[4-(2-methylpropyl)phenyl]propanoate

Systemtic Name: (3,5,6-trimethylpyrazin-2-yl)methyl 2-[4-(2-methylpropyl)phenyl]propanoate Openeye Name: (3,5,6-trimethylpyrazin-2-yl)methyl 2-(4-isobutylphenyl)propanoate CAS Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid (3,5,6-trimethyl-2-pyrazinyl)methyl ester IUPAC Name: (3,5,6-trimethylpyrazin-2-yl)methyl 2-[4-(2-methylpropyl)phenyl]propanoate Traditional Name: 2-(4-isobutylphenyl)propionic acid (3,5,6-trimethylpyrazin-2-yl)methyl ester Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=N1)C)COC(=O)C(C)C2=CC=C(C=C2)CC(C)C)C

Isomeric SMILES

CC1=C(N=C(C(=N1)C)COC(=O)C(C)C2=CC=C(C=C2)CC(C)C)C

InChI

InChI=1S/C21H28N2O2/c1-13(2)11-18-7-9-19(10-8-18)14(3)21(24)25-12-20-17(6)22-15(4)16(5)23-20/h7-10,13-14H,11-12H2,1-6H3