ditert-butyl 2-[2-(2-imidazol-1-ylethyl)piperidin-1-yl]carbonylpiperazine-1,4-dicarboxylate

Systemtic Name: ditert-butyl 2-[2-(2-imidazol-1-ylethyl)piperidin-1-yl]carbonylpiperazine-1,4-dicarboxylate Openeye Name: ditert-butyl 2-[2-(2-imidazol-1-ylethyl)piperidine-1-carbonyl]piperazine-1,4-dicarboxylate CAS Name: 2-[[2-[2-(1-imidazolyl)ethyl]-1-piperidinyl]-oxomethyl]piperazine-1,4-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[2-(2-imidazol-1-ylethyl)piperidine-1-carbonyl]piperazine-1,4-dicarboxylate Traditional Name: 2-[2-(2-imidazol-1-ylethyl)piperidine-1-carbonyl]piperazine-1,4-dicarboxylic acid ditert-butyl ester Formula: C25H41N5O5 MolecularWeight: 491.62354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(C1)C(=O)N2CCCCC2CCN3C=CN=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(C1)C(=O)N2CCCCC2CCN3C=CN=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H41N5O5/c1-24(2,3)34-22(32)28-15-16-30(23(33)35-25(4,5)6)20(17-28)21(31)29-12-8-7-9-19(29)10-13-27-14-11-26-18-27/h11,14,18-20H,7-10,12-13,15-17H2,1-6H3