tert-butyl 4-[4-[[(E)-3-(3-cyanophenyl)prop-2-enyl]amino]phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[[(E)-3-(3-cyanophenyl)prop-2-enyl]amino]phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[[(E)-3-(3-cyanophenyl)allyl]amino]phenoxy]piperidine-1-carboxylate CAS Name: 4-[4-[[(E)-3-(3-cyanophenyl)prop-2-enyl]amino]phenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[[(E)-3-(3-cyanophenyl)prop-2-enyl]amino]phenoxy]piperidine-1-carboxylate Traditional Name: 4-[4-[[(E)-3-(3-cyanophenyl)allyl]amino]phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC=C(C=C2)NCC=CC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC=C(C=C2)NC/C=C/C3=CC=CC(=C3)C#N

InChI

InChI=1S/C26H31N3O3/c1-26(2,3)32-25(30)29-16-13-24(14-17-29)31-23-11-9-22(10-12-23)28-15-5-8-20-6-4-7-21(18-20)19-27/h4-12,18,24,28H,13-17H2,1-3H3/b8-5+