O4-(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) O1-tert-butyl piperidine-1,4-dicarboxylate

Systemtic Name: O4-(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) O1-tert-butyl piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-(3-cyano-4-imino-2-oxo-pentyl) piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-(3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: 1-O-tert-butyl 4-O-(3-cyano-4-imino-2-oxopentyl) piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-(3-cyano-4-imino-2-keto-pentyl) ester Formula: C17H25N3O5 MolecularWeight: 351.3975

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H25N3O5/c1-11(19)13(9-18)14(21)10-24-15(22)12-5-7-20(8-6-12)16(23)25-17(2,3)4/h12-13,19H,5-8,10H2,1-4H3