dimethyl 7-tert-butyl-3-methyl-9-oxidanylidene-2,4-dipyridin-2-yl-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate

Systemtic Name: dimethyl 7-tert-butyl-3-methyl-9-oxidanylidene-2,4-dipyridin-2-yl-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate Openeye Name: dimethyl 7-tert-butyl-3-methyl-9-oxo-2,4-bis(2-pyridyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate CAS Name: 7-tert-butyl-3-methyl-9-oxo-2,4-bis(2-pyridinyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 7-tert-butyl-3-methyl-9-oxo-2,4-dipyridin-2-yl-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate Traditional Name: 7-tert-butyl-9-keto-3-methyl-2,4-bis(2-pyridyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid dimethyl ester Formula: C26H32N4O5 MolecularWeight: 480.55608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC2(C(N(C(C(C1)(C2=O)C(=O)OC)C3=CC=CC=N3)C)C4=CC=CC=N4)C(=O)OC

Isomeric SMILES

CC(C)(C)N1CC2(C(N(C(C(C1)(C2=O)C(=O)OC)C3=CC=CC=N3)C)C4=CC=CC=N4)C(=O)OC

InChI

InChI=1S/C26H32N4O5/c1-24(2,3)30-15-25(22(32)34-5)19(17-11-7-9-13-27-17)29(4)20(18-12-8-10-14-28-18)26(16-30,21(25)31)23(33)35-6/h7-14,19-20H,15-16H2,1-6H3