tert-butyl (2E)-2-cyano-2-[1-(2-phenylmethoxyethyl)pyrrolidin-2-ylidene]ethanoate

Systemtic Name: tert-butyl (2E)-2-cyano-2-[1-(2-phenylmethoxyethyl)pyrrolidin-2-ylidene]ethanoate Openeye Name: tert-butyl (2E)-2-[1-(2-benzyloxyethyl)pyrrolidin-2-ylidene]-2-cyano-acetate CAS Name: (2E)-2-cyano-2-[1-(2-phenylmethoxyethyl)-2-pyrrolidinylidene]acetic acid tert-butyl ester IUPAC Name: tert-butyl (2E)-2-cyano-2-[1-(2-phenylmethoxyethyl)pyrrolidin-2-ylidene]acetate Traditional Name: (2E)-2-[1-(2-benzoxyethyl)pyrrolidin-2-ylidene]-2-cyano-acetic acid tert-butyl ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=C1CCCN1CCOCC2=CC=CC=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)/C(=C/1\CCCN1CCOCC2=CC=CC=C2)/C#N

InChI

InChI=1S/C20H26N2O3/c1-20(2,3)25-19(23)17(14-21)18-10-7-11-22(18)12-13-24-15-16-8-5-4-6-9-16/h4-6,8-9H,7,10-13,15H2,1-3H3/b18-17+