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

Systemtic Name: dimethyl 3-methyl-9-oxidanylidene-7-phenethyl-2,4-dipyridin-2-yl-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate Openeye Name: dimethyl 3-methyl-9-oxo-7-phenethyl-2,4-bis(2-pyridyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate CAS Name: 3-methyl-9-oxo-7-phenethyl-2,4-bis(2-pyridinyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-9-oxo-7-phenethyl-2,4-dipyridin-2-yl-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylate Traditional Name: 9-keto-3-methyl-7-phenethyl-2,4-bis(2-pyridyl)-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid dimethyl ester Formula: C30H32N4O5 MolecularWeight: 528.59888

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C2(CN(CC(C1C3=CC=CC=N3)(C2=O)C(=O)OC)CCC4=CC=CC=C4)C(=O)OC)C5=CC=CC=N5

Isomeric SMILES

CN1C(C2(CN(CC(C1C3=CC=CC=N3)(C2=O)C(=O)OC)CCC4=CC=CC=C4)C(=O)OC)C5=CC=CC=N5

InChI

InChI=1S/C30H32N4O5/c1-33-24(22-13-7-9-16-31-22)29(27(36)38-2)19-34(18-15-21-11-5-4-6-12-21)20-30(26(29)35,28(37)39-3)25(33)23-14-8-10-17-32-23/h4-14,16-17,24-25H,15,18-20H2,1-3H3