tert-butyl 4-[4-(2-ethoxy-2-oxidanylidene-ethoxy)-3-methanoyl-phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(2-ethoxy-2-oxidanylidene-ethoxy)-3-methanoyl-phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(2-ethoxy-2-oxo-ethoxy)-3-formyl-phenyl]piperazine-1-carboxylate CAS Name: 4-[4-(2-ethoxy-2-oxoethoxy)-3-formylphenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(2-ethoxy-2-oxoethoxy)-3-formylphenyl]piperazine-1-carboxylate Traditional Name: 4-[4-(2-ethoxy-2-keto-ethoxy)-3-formyl-phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1)N2CCN(CC2)C(=O)OC(C)(C)C)C=O

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1)N2CCN(CC2)C(=O)OC(C)(C)C)C=O

InChI

InChI=1S/C20H28N2O6/c1-5-26-18(24)14-27-17-7-6-16(12-15(17)13-23)21-8-10-22(11-9-21)19(25)28-20(2,3)4/h6-7,12-13H,5,8-11,14H2,1-4H3