tert-butyl (2S,3R)-2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-3-phenylmethoxy-piperidine-1-carboxylate

Systemtic Name: tert-butyl (2S,3R)-2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-3-phenylmethoxy-piperidine-1-carboxylate Openeye Name: tert-butyl (2S,3R)-3-benzyloxy-2-[(E)-3-ethoxy-3-oxo-prop-1-enyl]piperidine-1-carboxylate CAS Name: (2S,3R)-2-[(E)-3-ethoxy-3-oxoprop-1-enyl]-3-phenylmethoxy-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-2-[(E)-3-ethoxy-3-oxoprop-1-enyl]-3-phenylmethoxypiperidine-1-carboxylate Traditional Name: (2S,3R)-3-benzoxy-2-[(E)-3-ethoxy-3-keto-prop-1-enyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H31NO5 MolecularWeight: 389.48524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1C(CCCN1C(=O)OC(C)(C)C)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C/[C@H]1[C@@H](CCCN1C(=O)OC(C)(C)C)OCC2=CC=CC=C2

InChI

InChI=1S/C22H31NO5/c1-5-26-20(24)14-13-18-19(27-16-17-10-7-6-8-11-17)12-9-15-23(18)21(25)28-22(2,3)4/h6-8,10-11,13-14,18-19H,5,9,12,15-16H2,1-4H3/b14-13+/t18-,19+/m0/s1