1-[1-(3-heptoxyphenyl)-2H-pyrazin-5-yl]propan-2-yl butanoate

Systemtic Name: 1-[1-(3-heptoxyphenyl)-2H-pyrazin-5-yl]propan-2-yl butanoate Openeye Name: [2-[1-(3-heptoxyphenyl)-2H-pyrazin-5-yl]-1-methyl-ethyl] butanoate CAS Name: butanoic acid 1-[1-(3-heptoxyphenyl)-2H-pyrazin-5-yl]propan-2-yl ester IUPAC Name: 1-[1-(3-heptoxyphenyl)-2H-pyrazin-5-yl]propan-2-yl butanoate Traditional Name: butyric acid [2-[1-(3-heptoxyphenyl)-2H-pyrazin-5-yl]-1-methyl-ethyl] ester Formula: C24H36N2O3 MolecularWeight: 400.55424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC(=C1)N2CC=NC(=C2)CC(C)OC(=O)CCC

Isomeric SMILES

CCCCCCCOC1=CC=CC(=C1)N2CC=NC(=C2)CC(C)OC(=O)CCC

InChI

InChI=1S/C24H36N2O3/c1-4-6-7-8-9-16-28-23-13-10-12-22(18-23)26-15-14-25-21(19-26)17-20(3)29-24(27)11-5-2/h10,12-14,18-20H,4-9,11,15-17H2,1-3H3