diethyl 3,4-diphenyl-2,8-diazabicyclo[2.2.2]oct-2-ene-5,6-dicarboxylate

Systemtic Name: diethyl 3,4-diphenyl-2,8-diazabicyclo[2.2.2]oct-2-ene-5,6-dicarboxylate Openeye Name: diethyl 3,4-diphenyl-2,8-diazabicyclo[2.2.2]oct-2-ene-5,6-dicarboxylate CAS Name: 3,4-diphenyl-2,8-diazabicyclo[2.2.2]oct-2-ene-5,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3,4-diphenyl-2,8-diazabicyclo[2.2.2]oct-2-ene-5,6-dicarboxylate Traditional Name: 3,4-diphenyl-2,8-diazabicyclo[2.2.2]oct-2-ene-5,6-dicarboxylic acid diethyl ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2CNC(C1C(=O)OCC)(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1C2CNC(C1C(=O)OCC)(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O4/c1-3-29-22(27)19-18-15-25-24(17-13-9-6-10-14-17,20(19)23(28)30-4-2)21(26-18)16-11-7-5-8-12-16/h5-14,18-20,25H,3-4,15H2,1-2H3