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

Systemtic Name: 1-[1-(3-octylphenyl)-2H-pyrazin-5-yl]propan-2-yl propanoate Openeye Name: [1-methyl-2-[1-(3-octylphenyl)-2H-pyrazin-5-yl]ethyl] propanoate CAS Name: propanoic 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 propanoate Traditional Name: propionic acid [1-methyl-2-[1-(3-octylphenyl)-2H-pyrazin-5-yl]ethyl] ester Formula: C24H36N2O2 MolecularWeight: 384.55484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H36N2O2/c1-4-6-7-8-9-10-12-21-13-11-14-23(18-21)26-16-15-25-22(19-26)17-20(3)28-24(27)5-2/h11,13-15,18-20H,4-10,12,16-17H2,1-3H3