(phenylmethyl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-2H-pyrazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-2H-pyrazine-1-carboxylate Openeye Name: benzyl 4-(tert-butoxycarbonylamino)-3-oxo-2H-pyrazine-1-carboxylate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-2H-pyrazine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-2H-pyrazine-1-carboxylate Traditional Name: 4-(tert-butoxycarbonylamino)-3-keto-2H-pyrazine-1-carboxylic acid benzyl ester Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1C=CN(CC1=O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NN1C=CN(CC1=O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H21N3O5/c1-17(2,3)25-15(22)18-20-10-9-19(11-14(20)21)16(23)24-12-13-7-5-4-6-8-13/h4-10H,11-12H2,1-3H3,(H,18,22)