diethyl 4,10-bis(oxidanylidene)-6-propyl-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylate

Systemtic Name: diethyl 4,10-bis(oxidanylidene)-6-propyl-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylate Openeye Name: diethyl 4,10-dioxo-6-propyl-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylate CAS Name: 4,10-dioxo-6-propyl-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4,10-dioxo-6-propyl-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylate Traditional Name: 4,10-diketo-6-propyl-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylic acid diethyl ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=C3C(=C1)C(=O)C=C(N3)C(=O)OCC)C(=O)C=C(N2)C(=O)OCC

Isomeric SMILES

CCCC1=C2C(=C3C(=C1)C(=O)C=C(N3)C(=O)OCC)C(=O)C=C(N2)C(=O)OCC

InChI

InChI=1S/C21H22N2O6/c1-4-7-11-8-12-15(24)9-13(20(26)28-5-2)23-19(12)17-16(25)10-14(22-18(11)17)21(27)29-6-3/h8-10H,4-7H2,1-3H3,(H,22,25)(H,23,24)