[4-bromanyl-2-(pyrazin-2-ylmethyl)phenoxy]methyl 2,2-dimethylpropanoate

Systemtic Name: [4-bromanyl-2-(pyrazin-2-ylmethyl)phenoxy]methyl 2,2-dimethylpropanoate Openeye Name: [4-bromo-2-(pyrazin-2-ylmethyl)phenoxy]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-bromo-2-(2-pyrazinylmethyl)phenoxy]methyl ester IUPAC Name: [4-bromo-2-(pyrazin-2-ylmethyl)phenoxy]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-bromo-2-(pyrazin-2-ylmethyl)phenoxy]methyl ester Formula: C17H19BrN2O3 MolecularWeight: 379.24836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCOC1=C(C=C(C=C1)Br)CC2=NC=CN=C2

Isomeric SMILES

CC(C)(C)C(=O)OCOC1=C(C=C(C=C1)Br)CC2=NC=CN=C2

InChI

InChI=1S/C17H19BrN2O3/c1-17(2,3)16(21)23-11-22-15-5-4-13(18)8-12(15)9-14-10-19-6-7-20-14/h4-8,10H,9,11H2,1-3H3