[5-[4-(2-methylbutoxy)phenyl]pyrazin-2-yl] pentanoate

Systemtic Name: [5-[4-(2-methylbutoxy)phenyl]pyrazin-2-yl] pentanoate Openeye Name: [5-[4-(2-methylbutoxy)phenyl]pyrazin-2-yl] pentanoate CAS Name: pentanoic acid [5-[4-(2-methylbutoxy)phenyl]-2-pyrazinyl] ester IUPAC Name: [5-[4-(2-methylbutoxy)phenyl]pyrazin-2-yl] pentanoate Traditional Name: valeric acid [5-[4-(2-methylbutoxy)phenyl]pyrazin-2-yl] ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=NC=C(N=C1)C2=CC=C(C=C2)OCC(C)CC

Isomeric SMILES

CCCCC(=O)OC1=NC=C(N=C1)C2=CC=C(C=C2)OCC(C)CC

InChI

InChI=1S/C20H26N2O3/c1-4-6-7-20(23)25-19-13-21-18(12-22-19)16-8-10-17(11-9-16)24-14-15(3)5-2/h8-13,15H,4-7,14H2,1-3H3