O4-[(4-cyanophenyl)methyl] O1-(phenylmethyl) piperazine-1,4-dicarboxylate

Systemtic Name: O4-[(4-cyanophenyl)methyl] O1-(phenylmethyl) piperazine-1,4-dicarboxylate Openeye Name: O1-benzyl O4-[(4-cyanophenyl)methyl] piperazine-1,4-dicarboxylate CAS Name: piperazine-1,4-dicarboxylic acid O4-[(4-cyanophenyl)methyl] ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-[(4-cyanophenyl)methyl] piperazine-1,4-dicarboxylate Traditional Name: piperazine-1,4-dicarboxylic acid O1-benzyl ester O4-(4-cyanobenzyl) ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H21N3O4/c22-14-17-6-8-19(9-7-17)16-28-21(26)24-12-10-23(11-13-24)20(25)27-15-18-4-2-1-3-5-18/h1-9H,10-13,15-16H2