O1-tert-butyl O4-[2-[(4-dimethylaminophenyl)methylamino]-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[2-[(4-dimethylaminophenyl)methylamino]-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-[2-[(4-dimethylaminophenyl)methylamino]-2-oxo-ethyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-[(4-dimethylaminophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 4-O-[2-[(4-dimethylaminophenyl)methylamino]-2-oxoethyl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-[[4-(dimethylamino)benzyl]amino]-2-keto-ethyl] ester Formula: C22H33N3O5 MolecularWeight: 419.51452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)OCC(=O)NCC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)OCC(=O)NCC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C22H33N3O5/c1-22(2,3)30-21(28)25-12-10-17(11-13-25)20(27)29-15-19(26)23-14-16-6-8-18(9-7-16)24(4)5/h6-9,17H,10-15H2,1-5H3,(H,23,26)