3-(3-butylpyrazin-2-yl)-3-oxidanyl-3-phenyl-propanoic acid

Systemtic Name: 3-(3-butylpyrazin-2-yl)-3-oxidanyl-3-phenyl-propanoic acid Openeye Name: 3-(3-butylpyrazin-2-yl)-3-hydroxy-3-phenyl-propanoic acid CAS Name: 3-(3-butyl-2-pyrazinyl)-3-hydroxy-3-phenylpropanoic acid IUPAC Name: 3-(3-butylpyrazin-2-yl)-3-hydroxy-3-phenylpropanoic acid Traditional Name: 3-(3-butylpyrazin-2-yl)-3-hydroxy-3-phenyl-propionic acid Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=CN=C1C(CC(=O)O)(C2=CC=CC=C2)O

Isomeric SMILES

CCCCC1=NC=CN=C1C(CC(=O)O)(C2=CC=CC=C2)O

InChI

InChI=1S/C17H20N2O3/c1-2-3-9-14-16(19-11-10-18-14)17(22,12-15(20)21)13-7-5-4-6-8-13/h4-8,10-11,22H,2-3,9,12H2,1H3,(H,20,21)