tert-butyl 4-[(E)-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-enoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(E)-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-enoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(E)-3-[4-(2-pyridylmethoxy)phenyl]prop-2-enoyl]piperazine-1-carboxylate CAS Name: 4-[(E)-1-oxo-3-[4-(2-pyridinylmethoxy)phenyl]prop-2-enyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E)-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-enoyl]piperazine-1-carboxylate Traditional Name: 4-[(E)-3-[4-(2-pyridylmethoxy)phenyl]acryloyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C=CC2=CC=C(C=C2)OCC3=CC=CC=N3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)/C=C/C2=CC=C(C=C2)OCC3=CC=CC=N3

InChI

InChI=1S/C24H29N3O4/c1-24(2,3)31-23(29)27-16-14-26(15-17-27)22(28)12-9-19-7-10-21(11-8-19)30-18-20-6-4-5-13-25-20/h4-13H,14-18H2,1-3H3/b12-9+