dimethyl 5-[2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[4-[(E)-cinnamyl]piperazin-1-yl]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]ethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[4-[(E)-cinnamyl]piperazino]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CN2CCN(CC2)CC=CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CN2CCN(CC2)C/C=C/C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C25H29N3O5/c1-32-24(30)20-15-21(25(31)33-2)17-22(16-20)26-23(29)18-28-13-11-27(12-14-28)10-6-9-19-7-4-3-5-8-19/h3-9,15-17H,10-14,18H2,1-2H3,(H,26,29)/b9-6+