tert-butyl 2-ethanoyl-3-(4-methylphenyl)-4-nitro-4-phenyl-butanoate

Systemtic Name: tert-butyl 2-ethanoyl-3-(4-methylphenyl)-4-nitro-4-phenyl-butanoate Openeye Name: tert-butyl 2-acetyl-4-nitro-4-phenyl-3-(p-tolyl)butanoate CAS Name: 2-acetyl-3-(4-methylphenyl)-4-nitro-4-phenylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-acetyl-3-(4-methylphenyl)-4-nitro-4-phenylbutanoate Traditional Name: 2-acetyl-4-nitro-4-phenyl-3-(p-tolyl)butyric acid tert-butyl ester Formula: C23H27NO5 MolecularWeight: 397.46418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C2=CC=CC=C2)[N+](=O)[O-])C(C(=O)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C(C2=CC=CC=C2)[N+](=O)[O-])C(C(=O)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H27NO5/c1-15-11-13-17(14-12-15)20(19(16(2)25)22(26)29-23(3,4)5)21(24(27)28)18-9-7-6-8-10-18/h6-14,19-21H,1-5H3