ditert-butyl 6-azanyl-5,7,7-tricyano-spiro[3,8a-dihydro-1H-isoquinoline-8,4'-piperidine]-1',2-dicarboxylate

Systemtic Name: ditert-butyl 6-azanyl-5,7,7-tricyano-spiro[3,8a-dihydro-1H-isoquinoline-8,4'-piperidine]-1',2-dicarboxylate Openeye Name: ditert-butyl 6-amino-5,7,7-tricyano-spiro[3,8a-dihydro-1H-isoquinoline-8,4'-piperidine]-1',2-dicarboxylate CAS Name: 6-amino-5,7,7-tricyanospiro[3,8a-dihydro-1H-isoquinoline-8,4'-piperidine]-1',2-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 6-amino-5,7,7-tricyanospiro[3,8a-dihydro-1H-isoquinoline-8,4'-piperidine]-1',2-dicarboxylate Traditional Name: 6-amino-5,7,7-tricyano-spiro[3,8a-dihydro-1H-isoquinoline-8,4'-piperidine]-1',2-dicarboxylic acid ditert-butyl ester Formula: C26H34N6O4 MolecularWeight: 494.58596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2(CC1)C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2(CC1)C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H34N6O4/c1-23(2,3)35-21(33)31-11-8-25(9-12-31)19-14-32(22(34)36-24(4,5)6)10-7-17(19)18(13-27)20(30)26(25,15-28)16-29/h7,19H,8-12,14,30H2,1-6H3