ditert-butyl 2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl]piperazine-1,4-dicarboxylate

Systemtic Name: ditert-butyl 2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl]piperazine-1,4-dicarboxylate Openeye Name: ditert-butyl 2-[(E)-3-(3,4-dimethoxyphenyl)allyl]piperazine-1,4-dicarboxylate CAS Name: 2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl]piperazine-1,4-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl]piperazine-1,4-dicarboxylate Traditional Name: 2-[(E)-3-(3,4-dimethoxyphenyl)allyl]piperazine-1,4-dicarboxylic acid ditert-butyl ester Formula: C25H38N2O6 MolecularWeight: 462.57902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(C1)CC=CC2=CC(=C(C=C2)OC)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(C1)C/C=C/C2=CC(=C(C=C2)OC)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H38N2O6/c1-24(2,3)32-22(28)26-14-15-27(23(29)33-25(4,5)6)19(17-26)11-9-10-18-12-13-20(30-7)21(16-18)31-8/h9-10,12-13,16,19H,11,14-15,17H2,1-8H3/b10-9+