3-methyl-2-(1-pyrazin-2-ylethyl)pentanoic acid

Systemtic Name: 3-methyl-2-(1-pyrazin-2-ylethyl)pentanoic acid Openeye Name: 3-methyl-2-(1-pyrazin-2-ylethyl)pentanoic acid CAS Name: 3-methyl-2-[1-(2-pyrazinyl)ethyl]pentanoic acid IUPAC Name: 3-methyl-2-(1-pyrazin-2-ylethyl)pentanoic acid Traditional Name: 3-methyl-2-(1-pyrazin-2-ylethyl)valeric acid Formula: C12H18N2O2 MolecularWeight: 222.28352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C)C1=NC=CN=C1)C(=O)O

Isomeric SMILES

CCC(C)C(C(C)C1=NC=CN=C1)C(=O)O

InChI

InChI=1S/C12H18N2O2/c1-4-8(2)11(12(15)16)9(3)10-7-13-5-6-14-10/h5-9,11H,4H2,1-3H3,(H,15,16)