O1-tert-butyl O4-[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-[2-(4-methyl-3-nitro-phenyl)-2-oxo-ethyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-(4-methyl-3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 4-O-[2-(4-methyl-3-nitrophenyl)-2-oxoethyl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-keto-2-(4-methyl-3-nitro-phenyl)ethyl] ester Formula: C20H26N2O7 MolecularWeight: 406.42964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H26N2O7/c1-13-5-6-15(11-16(13)22(26)27)17(23)12-28-18(24)14-7-9-21(10-8-14)19(25)29-20(2,3)4/h5-6,11,14H,7-10,12H2,1-4H3