(phenylmethyl) 2-(3-methoxy-3-oxidanylidene-propyl)-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-3-oxidanylidene-2H-pyrazine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-(3-methoxy-3-oxidanylidene-propyl)-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-3-oxidanylidene-2H-pyrazine-1-carboxylate Openeye Name: benzyl 4-(2-tert-butoxy-2-oxo-ethyl)-2-(3-methoxy-3-oxo-propyl)-3-oxo-2H-pyrazine-1-carboxylate CAS Name: 2-(3-methoxy-3-oxopropyl)-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-3-oxo-2H-pyrazine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3-methoxy-3-oxopropyl)-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-3-oxo-2H-pyrazine-1-carboxylate Traditional Name: 4-(2-tert-butoxy-2-keto-ethyl)-3-keto-2-(3-keto-3-methoxy-propyl)-2H-pyrazine-1-carboxylic acid benzyl ester Formula: C22H28N2O7 MolecularWeight: 432.46692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C=CN(C(C1=O)CCC(=O)OC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CN1C=CN(C(C1=O)CCC(=O)OC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O7/c1-22(2,3)31-19(26)14-23-12-13-24(17(20(23)27)10-11-18(25)29-4)21(28)30-15-16-8-6-5-7-9-16/h5-9,12-13,17H,10-11,14-15H2,1-4H3