ethyl 4-chloranyl-8-ethanoyl-7-oxidanylidene-8H-1,10-phenanthroline-3-carboxylate

Systemtic Name: ethyl 4-chloranyl-8-ethanoyl-7-oxidanylidene-8H-1,10-phenanthroline-3-carboxylate Openeye Name: ethyl 8-acetyl-4-chloro-7-oxo-8H-1,10-phenanthroline-3-carboxylate CAS Name: 8-acetyl-4-chloro-7-oxo-8H-1,10-phenanthroline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-acetyl-4-chloro-7-oxo-8H-1,10-phenanthroline-3-carboxylate Traditional Name: 8-acetyl-4-chloro-7-keto-8H-1,10-phenanthroline-3-carboxylic acid ethyl ester Formula: C17H13ClN2O4 MolecularWeight: 344.74912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1Cl)C=CC3=C2N=CC(C3=O)C(=O)C

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1Cl)C=CC3=C2N=CC(C3=O)C(=O)C

InChI

InChI=1S/C17H13ClN2O4/c1-3-24-17(23)12-7-20-14-9(13(12)18)4-5-10-15(14)19-6-11(8(2)21)16(10)22/h4-7,11H,3H2,1-2H3