O1-tert-butyl O4-[2-[2-cyanoethyl-(4-methylphenyl)amino]-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[2-[2-cyanoethyl-(4-methylphenyl)amino]-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-[2-[N-(2-cyanoethyl)-4-methyl-anilino]-2-oxo-ethyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-[N-(2-cyanoethyl)-4-methylanilino]-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 4-O-[2-[N-(2-cyanoethyl)-4-methylanilino]-2-oxoethyl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-[N-(2-cyanoethyl)-4-methyl-anilino]-2-keto-ethyl] ester Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC#N)C(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC#N)C(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H31N3O5/c1-17-6-8-19(9-7-17)26(13-5-12-24)20(27)16-30-21(28)18-10-14-25(15-11-18)22(29)31-23(2,3)4/h6-9,18H,5,10-11,13-16H2,1-4H3