tert-butyl 4-[(E,2R)-1-oxidanylidene-4-phenyl-but-3-en-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(E,2R)-1-oxidanylidene-4-phenyl-but-3-en-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(E,1R)-1-formyl-3-phenyl-allyl]piperidine-1-carboxylate CAS Name: 4-[(E,2R)-1-oxo-4-phenylbut-3-en-2-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E,2R)-1-oxo-4-phenylbut-3-en-2-yl]piperidine-1-carboxylate Traditional Name: 4-[(E,1R)-1-formyl-3-phenyl-allyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(C=CC2=CC=CC=C2)C=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)[C@H](/C=C/C2=CC=CC=C2)C=O

InChI

InChI=1S/C20H27NO3/c1-20(2,3)24-19(23)21-13-11-17(12-14-21)18(15-22)10-9-16-7-5-4-6-8-16/h4-10,15,17-18H,11-14H2,1-3H3/b10-9+/t18-/m1/s1