diethyl 6,7-ditert-butyl-4-phenyl-7-aza-1-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate

Systemtic Name: diethyl 6,7-ditert-butyl-4-phenyl-7-aza-1-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate Openeye Name: diethyl 6,7-ditert-butyl-4-phenyl-7-aza-1-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate CAS Name: 6,7-ditert-butyl-4-phenyl-7-aza-1-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 6,7-ditert-butyl-4-phenyl-7-aza-1-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate Traditional Name: 6,7-ditert-butyl-4-phenyl-7-aza-1-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid diethyl ester Formula: C25H34NO4P MolecularWeight: 443.515521

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(P2C(=CC1(N2C(C)(C)C)C3=CC=CC=C3)C(C)(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(P2C(=CC1(N2C(C)(C)C)C3=CC=CC=C3)C(C)(C)C)C(=O)OCC

InChI

InChI=1S/C25H34NO4P/c1-9-29-21(27)19-20(22(28)30-10-2)31-18(23(3,4)5)16-25(19,26(31)24(6,7)8)17-14-12-11-13-15-17/h11-16H,9-10H2,1-8H3