1-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]propan-2-yl pentanoate

Systemtic Name: 1-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]propan-2-yl pentanoate Openeye Name: [2-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]-1-methyl-ethyl] pentanoate CAS Name: pentanoic acid 1-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]propan-2-yl ester IUPAC Name: 1-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]propan-2-yl pentanoate Traditional Name: valeric acid [2-[1-(3-hexylphenyl)-2H-pyrazin-5-yl]-1-methyl-ethyl] ester Formula: C24H36N2O2 MolecularWeight: 384.55484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=CC=C1)N2CC=NC(=C2)CC(C)OC(=O)CCCC

Isomeric SMILES

CCCCCCC1=CC(=CC=C1)N2CC=NC(=C2)CC(C)OC(=O)CCCC

InChI

InChI=1S/C24H36N2O2/c1-4-6-8-9-11-21-12-10-13-23(18-21)26-16-15-25-22(19-26)17-20(3)28-24(27)14-7-5-2/h10,12-13,15,18-20H,4-9,11,14,16-17H2,1-3H3