ethyl 5-(4-methylphenyl)-2-(4-nitrophenyl)-5-oxidanylidene-pentanoate

Systemtic Name: ethyl 5-(4-methylphenyl)-2-(4-nitrophenyl)-5-oxidanylidene-pentanoate Openeye Name: ethyl 2-(4-nitrophenyl)-5-oxo-5-(p-tolyl)pentanoate CAS Name: 5-(4-methylphenyl)-2-(4-nitrophenyl)-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 5-(4-methylphenyl)-2-(4-nitrophenyl)-5-oxopentanoate Traditional Name: 5-keto-2-(4-nitrophenyl)-5-(p-tolyl)valeric acid ethyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)C1=CC=C(C=C1)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(CCC(=O)C1=CC=C(C=C1)C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H21NO5/c1-3-26-20(23)18(15-8-10-17(11-9-15)21(24)25)12-13-19(22)16-6-4-14(2)5-7-16/h4-11,18H,3,12-13H2,1-2H3