O4-tert-butyl O1-(phenylmethyl) 5-(tert-butylcarbamoyl)-2,3-dihydropyrazine-1,4-dicarboxylate

Systemtic Name: O4-tert-butyl O1-(phenylmethyl) 5-(tert-butylcarbamoyl)-2,3-dihydropyrazine-1,4-dicarboxylate Openeye Name: O1-benzyl O4-tert-butyl 5-(tert-butylcarbamoyl)-2,3-dihydropyrazine-1,4-dicarboxylate CAS Name: 5-[(tert-butylamino)-oxomethyl]-2,3-dihydropyrazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-tert-butyl 5-(tert-butylcarbamoyl)-2,3-dihydropyrazine-1,4-dicarboxylate Traditional Name: 5-(tert-butylcarbamoyl)-2,3-dihydropyrazine-1,4-dicarboxylic acid O1-benzyl ester O4-tert-butyl ester Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CN(CCN1C(=O)OC(C)(C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC(=O)C1=CN(CCN1C(=O)OC(C)(C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H31N3O5/c1-21(2,3)23-18(26)17-14-24(12-13-25(17)20(28)30-22(4,5)6)19(27)29-15-16-10-8-7-9-11-16/h7-11,14H,12-13,15H2,1-6H3,(H,23,26)