diethyl 4,6-bis(4-nitrophenyl)-2,8-diphenyl-6,9-dihydro-4H-pyrimido[1,2-a]pyrimidine-3,7-dicarboxylate

Systemtic Name: diethyl 4,6-bis(4-nitrophenyl)-2,8-diphenyl-6,9-dihydro-4H-pyrimido[1,2-a]pyrimidine-3,7-dicarboxylate Openeye Name: diethyl 4,6-bis(4-nitrophenyl)-2,8-diphenyl-6,9-dihydro-4H-pyrimido[1,2-a]pyrimidine-3,7-dicarboxylate CAS Name: 4,6-bis(4-nitrophenyl)-2,8-diphenyl-6,9-dihydro-4H-pyrimido[1,2-a]pyrimidine-3,7-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4,6-bis(4-nitrophenyl)-2,8-diphenyl-6,9-dihydro-4H-pyrimido[1,2-a]pyrimidine-3,7-dicarboxylate Traditional Name: 4,6-bis(4-nitrophenyl)-2,8-diphenyl-6,9-dihydro-4H-pyrimido[1,2-a]pyrimidine-3,7-dicarboxylic acid diethyl ester Formula: C37H31N5O8 MolecularWeight: 673.67074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=NC(=C(C(N2C1C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OCC)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=C(NC2=NC(=C(C(N2C1C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OCC)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C37H31N5O8/c1-3-49-35(43)29-31(23-11-7-5-8-12-23)38-37-39-32(24-13-9-6-10-14-24)30(36(44)50-4-2)34(26-17-21-28(22-18-26)42(47)48)40(37)33(29)25-15-19-27(20-16-25)41(45)46/h5-22,33-34H,3-4H2,1-2H3,(H,38,39)