tert-butyl 4-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[[(E)-3-(3-pyridyl)prop-2-enoyl]amino]ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[(E)-3-(3-pyridyl)acryloyl]amino]ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CCNC(=O)C=CC2=CN=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CCNC(=O)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C19H28N4O3/c1-19(2,3)26-18(25)23-13-11-22(12-14-23)10-9-21-17(24)7-6-16-5-4-8-20-15-16/h4-8,15H,9-14H2,1-3H3,(H,21,24)/b7-6+