diethyl 2-(2,3,4,8,9,10-hexahydro-1H-1,7-phenanthrolin-7-ylmethylidene)propanedioate

Systemtic Name: diethyl 2-(2,3,4,8,9,10-hexahydro-1H-1,7-phenanthrolin-7-ylmethylidene)propanedioate Openeye Name: diethyl 2-(2,3,4,8,9,10-hexahydro-1H-1,7-phenanthrolin-7-ylmethylene)propanedioate CAS Name: 2-(2,3,4,8,9,10-hexahydro-1H-1,7-phenanthrolin-7-ylmethylidene)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2,3,4,8,9,10-hexahydro-1H-1,7-phenanthrolin-7-ylmethylidene)propanedioate Traditional Name: 2-(2,3,4,8,9,10-hexahydro-1H-1,7-phenanthrolin-7-ylmethylene)malonic acid diethyl ester Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CN1CCCC2=C1C=CC3=C2NCCC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CN1CCCC2=C1C=CC3=C2NCCC3)C(=O)OCC

InChI

InChI=1S/C20H26N2O4/c1-3-25-19(23)16(20(24)26-4-2)13-22-12-6-8-15-17(22)10-9-14-7-5-11-21-18(14)15/h9-10,13,21H,3-8,11-12H2,1-2H3