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

Systemtic Name: 1-[1-(3-octoxyphenyl)-2H-pyrazin-5-yl]propan-2-yl propanoate Openeye Name: [1-methyl-2-[1-(3-octoxyphenyl)-2H-pyrazin-5-yl]ethyl] propanoate CAS Name: propanoic acid 1-[1-(3-octoxyphenyl)-2H-pyrazin-5-yl]propan-2-yl ester IUPAC Name: 1-[1-(3-octoxyphenyl)-2H-pyrazin-5-yl]propan-2-yl propanoate Traditional Name: propionic acid [1-methyl-2-[1-(3-octoxyphenyl)-2H-pyrazin-5-yl]ethyl] ester Formula: C24H36N2O3 MolecularWeight: 400.55424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=CC(=C1)N2CC=NC(=C2)CC(C)OC(=O)CC

Isomeric SMILES

CCCCCCCCOC1=CC=CC(=C1)N2CC=NC(=C2)CC(C)OC(=O)CC

InChI

InChI=1S/C24H36N2O3/c1-4-6-7-8-9-10-16-28-23-13-11-12-22(18-23)26-15-14-25-21(19-26)17-20(3)29-24(27)5-2/h11-14,18-20H,4-10,15-17H2,1-3H3