O4-tert-butyl O1-(phenylmethyl) 2-cyano-2-methyl-piperazine-1,4-dicarboxylate

Systemtic Name: O4-tert-butyl O1-(phenylmethyl) 2-cyano-2-methyl-piperazine-1,4-dicarboxylate Openeye Name: O1-benzyl O4-tert-butyl 2-cyano-2-methyl-piperazine-1,4-dicarboxylate CAS Name: 2-cyano-2-methylpiperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-tert-butyl 2-cyano-2-methylpiperazine-1,4-dicarboxylate Traditional Name: 2-cyano-2-methyl-piperazine-1,4-dicarboxylic acid O1-benzyl ester O4-tert-butyl ester Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCN1C(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C)C#N

Isomeric SMILES

CC1(CN(CCN1C(=O)OCC2=CC=CC=C2)C(=O)OC(C)(C)C)C#N

InChI

InChI=1S/C19H25N3O4/c1-18(2,3)26-16(23)21-10-11-22(19(4,13-20)14-21)17(24)25-12-15-8-6-5-7-9-15/h5-9H,10-12,14H2,1-4H3