tert-butyl 8'-cyano-2,4,6-tris(oxidanylidene)spiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-3'-carboxylate

Systemtic Name: tert-butyl 8'-cyano-2,4,6-tris(oxidanylidene)spiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-3'-carboxylate Openeye Name: tert-butyl 8-cyano-2',4',6'-trioxo-spiro[2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline-5,5'-hexahydropyrimidine]-3-carboxylate CAS Name: 8'-cyano-2,4,6-trioxo-3'-spiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8'-cyano-2,4,6-trioxospiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-3'-carboxylate Traditional Name: 8-cyano-2',4',6'-triketo-spiro[2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline-5,5'-hexahydropyrimidine]-3-carboxylic acid tert-butyl ester Formula: C21H23N5O5 MolecularWeight: 425.43782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN2C(C1)C3(CC4=C2C=CC(=C4)C#N)C(=O)NC(=O)NC3=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN2C(C1)C3(CC4=C2C=CC(=C4)C#N)C(=O)NC(=O)NC3=O

InChI

InChI=1S/C21H23N5O5/c1-20(2,3)31-19(30)25-6-7-26-14-5-4-12(10-22)8-13(14)9-21(15(26)11-25)16(27)23-18(29)24-17(21)28/h4-5,8,15H,6-7,9,11H2,1-3H3,(H2,23,24,27,28,29)