ethyl 4-oxidanylidene-7-phenyl-1H-1,10-phenanthroline-3-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-7-phenyl-1H-1,10-phenanthroline-3-carboxylate Openeye Name: ethyl 4-oxo-7-phenyl-1H-1,10-phenanthroline-3-carboxylate CAS Name: 4-oxo-7-phenyl-1H-1,10-phenanthroline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-7-phenyl-1H-1,10-phenanthroline-3-carboxylate Traditional Name: 4-keto-7-phenyl-1H-1,10-phenanthroline-3-carboxylic acid ethyl ester Formula: C21H16N2O3 MolecularWeight: 344.36334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C1=O)C=CC3=C(C=CN=C32)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C1=O)C=CC3=C(C=CN=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O3/c1-2-26-21(25)17-12-23-19-16(20(17)24)9-8-15-14(10-11-22-18(15)19)13-6-4-3-5-7-13/h3-12H,2H2,1H3,(H,23,24)