(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 3-azanylpyrazine-2-carboxylate

Systemtic Name: (3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 3-azanylpyrazine-2-carboxylate Openeye Name: (3-acetyl-2,4,6-trimethyl-phenyl)methyl 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid (3-acetyl-2,4,6-trimethylphenyl)methyl ester IUPAC Name: (3-acetyl-2,4,6-trimethylphenyl)methyl 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid (3-acetyl-2,4,6-trimethyl-benzyl) ester Formula: C17H19N3O3 MolecularWeight: 313.35106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=NC=CN=C2N)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=NC=CN=C2N)C

InChI

InChI=1S/C17H19N3O3/c1-9-7-10(2)14(12(4)21)11(3)13(9)8-23-17(22)15-16(18)20-6-5-19-15/h5-7H,8H2,1-4H3,(H2,18,20)