methyl 2-methyl-2-(4-nitrophenyl)-5-oxidanylidene-5-phenyl-pentanoate

Systemtic Name: methyl 2-methyl-2-(4-nitrophenyl)-5-oxidanylidene-5-phenyl-pentanoate Openeye Name: methyl 2-methyl-2-(4-nitrophenyl)-5-oxo-5-phenyl-pentanoate CAS Name: 2-methyl-2-(4-nitrophenyl)-5-oxo-5-phenylpentanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-(4-nitrophenyl)-5-oxo-5-phenylpentanoate Traditional Name: 5-keto-2-methyl-2-(4-nitrophenyl)-5-phenyl-valeric acid methyl ester Formula: C19H19NO5 MolecularWeight: 341.35786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19NO5/c1-19(18(22)25-2,15-8-10-16(11-9-15)20(23)24)13-12-17(21)14-6-4-3-5-7-14/h3-11H,12-13H2,1-2H3