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

Systemtic Name: 1-[1-(3-octylphenyl)-2H-pyrazin-5-yl]propan-2-yl ethanoate Openeye Name: [1-methyl-2-[1-(3-octylphenyl)-2H-pyrazin-5-yl]ethyl] acetate CAS Name: acetic acid 1-[1-(3-octylphenyl)-2H-pyrazin-5-yl]propan-2-yl ester IUPAC Name: 1-[1-(3-octylphenyl)-2H-pyrazin-5-yl]propan-2-yl acetate Traditional Name: acetic acid [1-methyl-2-[1-(3-octylphenyl)-2H-pyrazin-5-yl]ethyl] ester Formula: C23H34N2O2 MolecularWeight: 370.52826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=CC=C1)N2CC=NC(=C2)CC(C)OC(=O)C

Isomeric SMILES

CCCCCCCCC1=CC(=CC=C1)N2CC=NC(=C2)CC(C)OC(=O)C

InChI

InChI=1S/C23H34N2O2/c1-4-5-6-7-8-9-11-21-12-10-13-23(17-21)25-15-14-24-22(18-25)16-19(2)27-20(3)26/h10,12-14,17-19H,4-9,11,15-16H2,1-3H3