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

Systemtic Name: 1-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]propan-2-yl ethanoate Openeye Name: [2-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]-1-methyl-ethyl] acetate CAS Name: acetic 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 acetate Traditional Name: acetic acid [2-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]-1-methyl-ethyl] ester Formula: C21H30N2O2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O2/c1-4-5-6-7-9-19-10-8-11-21(15-19)23-13-12-22-20(16-23)14-17(2)25-18(3)24/h8,10-12,15-17H,4-7,9,13-14H2,1-3H3