dimethyl 7-methyl-9-oxidanylidene-2,4-dipyridin-2-yl-3-(pyridin-2-ylmethyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate

Systemtic Name: dimethyl 7-methyl-9-oxidanylidene-2,4-dipyridin-2-yl-3-(pyridin-2-ylmethyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate Openeye Name: dimethyl 7-methyl-9-oxo-2,4-bis(2-pyridyl)-3-(2-pyridylmethyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate CAS Name: 7-methyl-9-oxo-2,4-bis(2-pyridinyl)-3-(2-pyridinylmethyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 7-methyl-9-oxo-2,4-dipyridin-2-yl-3-(pyridin-2-ylmethyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate Traditional Name: 9-keto-7-methyl-2,4-bis(2-pyridyl)-3-(2-pyridylmethyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid dimethyl ester Formula: C28H29N5O5 MolecularWeight: 515.56036

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2(C(N(C(C(C1)(C2=O)C(=O)OC)C3=CC=CC=N3)CC4=CC=CC=N4)C5=CC=CC=N5)C(=O)OC

Isomeric SMILES

CN1CC2(C(N(C(C(C1)(C2=O)C(=O)OC)C3=CC=CC=N3)CC4=CC=CC=N4)C5=CC=CC=N5)C(=O)OC

InChI

InChI=1S/C28H29N5O5/c1-32-17-27(25(35)37-2)22(20-11-5-8-14-30-20)33(16-19-10-4-7-13-29-19)23(21-12-6-9-15-31-21)28(18-32,24(27)34)26(36)38-3/h4-15,22-23H,16-18H2,1-3H3