tert-butyl 1,2,3,4-tetrahydropyrazine-2-carboxylate; (phenylmethyl) N-(2,2-dimethylpropanoyl)carbamate

Systemtic Name: tert-butyl 1,2,3,4-tetrahydropyrazine-2-carboxylate; (phenylmethyl) N-(2,2-dimethylpropanoyl)carbamate Openeye Name: benzyl N-(2,2-dimethylpropanoyl)carbamate; tert-butyl 1,2,3,4-tetrahydropyrazine-2-carboxylate CAS Name: N-(2,2-dimethyl-1-oxopropyl)carbamic acid (phenylmethyl) ester; 1,2,3,4-tetrahydropyrazine-2-carboxylic acid tert-butyl ester IUPAC Name: benzyl N-(2,2-dimethylpropanoyl)carbamate; tert-butyl 1,2,3,4-tetrahydropyrazine-2-carboxylate Traditional Name: N-pivaloylcarbamic acid benzyl ester; 1,2,3,4-tetrahydropyrazine-2-carboxylic acid tert-butyl ester Formula: C22H33N3O5 MolecularWeight: 419.51452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=O)OCC1=CC=CC=C1.CC(C)(C)OC(=O)C1CNC=CN1

Isomeric SMILES

CC(C)(C)C(=O)NC(=O)OCC1=CC=CC=C1.CC(C)(C)OC(=O)C1CNC=CN1

InChI

InChI=1S/C13H17NO3.C9H16N2O2/c1-13(2,3)11(15)14-12(16)17-9-10-7-5-4-6-8-10;1-9(2,3)13-8(12)7-6-10-4-5-11-7/h4-8H,9H2,1-3H3,(H,14,15,16);4-5,7,10-11H,6H2,1-3H3