tert-butyl 2-[3-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[3-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]phenoxy]ethanoate Openeye Name: tert-butyl 2-[3-[2-[[(E)-3-(3-pyridyl)prop-2-enoyl]amino]ethyl]phenoxy]acetate CAS Name: 2-[3-[2-[[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]ethyl]phenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]phenoxy]acetate Traditional Name: 2-[3-[2-[[(E)-3-(3-pyridyl)acryloyl]amino]ethyl]phenoxy]acetic acid tert-butyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=CC=CC(=C1)CCNC(=O)C=CC2=CN=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)COC1=CC=CC(=C1)CCNC(=O)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C22H26N2O4/c1-22(2,3)28-21(26)16-27-19-8-4-6-17(14-19)11-13-24-20(25)10-9-18-7-5-12-23-15-18/h4-10,12,14-15H,11,13,16H2,1-3H3,(H,24,25)/b10-9+