1-[5-(4-octoxyphenyl)pyrazin-2-yl]oxypropan-2-yl pentanoate

Systemtic Name: 1-[5-(4-octoxyphenyl)pyrazin-2-yl]oxypropan-2-yl pentanoate Openeye Name: [1-methyl-2-[5-(4-octoxyphenyl)pyrazin-2-yl]oxy-ethyl] pentanoate CAS Name: pentanoic acid 1-[[5-(4-octoxyphenyl)-2-pyrazinyl]oxy]propan-2-yl ester IUPAC Name: 1-[5-(4-octoxyphenyl)pyrazin-2-yl]oxypropan-2-yl pentanoate Traditional Name: valeric acid [1-methyl-2-[5-(4-octoxyphenyl)pyrazin-2-yl]oxy-ethyl] ester Formula: C26H38N2O4 MolecularWeight: 442.59092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CN=C(C=N2)OCC(C)OC(=O)CCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CN=C(C=N2)OCC(C)OC(=O)CCCC

InChI

InChI=1S/C26H38N2O4/c1-4-6-8-9-10-11-17-30-23-15-13-22(14-16-23)24-18-28-25(19-27-24)31-20-21(3)32-26(29)12-7-5-2/h13-16,18-19,21H,4-12,17,20H2,1-3H3