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

Systemtic Name: O1-tert-butyl O4-[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-[2-(4-methyl-2-nitro-anilino)-2-oxo-1-phenyl-ethyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: 1-O-tert-butyl 4-O-[2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-keto-2-(4-methyl-2-nitro-anilino)-1-phenyl-ethyl] ester Formula: C26H31N3O7 MolecularWeight: 497.54024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3CCN(CC3)C(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3CCN(CC3)C(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C26H31N3O7/c1-17-10-11-20(21(16-17)29(33)34)27-23(30)22(18-8-6-5-7-9-18)35-24(31)19-12-14-28(15-13-19)25(32)36-26(2,3)4/h5-11,16,19,22H,12-15H2,1-4H3,(H,27,30)