1-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]propan-2-yl propanoate

Systemtic Name: 1-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]propan-2-yl propanoate Openeye Name: [2-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]-1-methyl-ethyl] propanoate CAS Name: propanoic acid 1-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]propan-2-yl ester IUPAC Name: 1-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]propan-2-yl propanoate Traditional Name: propionic acid [2-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]-1-methyl-ethyl] ester Formula: C22H32N2O2 MolecularWeight: 356.50168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=CC=C1)N2CC=NC(=C2)CC(C)OC(=O)CC

Isomeric SMILES

CCCCCCC1=CC(=CC=C1)N2CC=NC(=C2)CC(C)OC(=O)CC

InChI

InChI=1S/C22H32N2O2/c1-4-6-7-8-10-19-11-9-12-21(16-19)24-14-13-23-20(17-24)15-18(3)26-22(25)5-2/h9,11-13,16-18H,4-8,10,14-15H2,1-3H3