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

Systemtic Name: tert-butyl (2S,3R)-2-[(Z)-3-methoxy-3-oxidanylidene-prop-1-enyl]-3-phenylmethoxy-piperidine-1-carboxylate Openeye Name: tert-butyl (2S,3R)-3-benzyloxy-2-[(Z)-3-methoxy-3-oxo-prop-1-enyl]piperidine-1-carboxylate CAS Name: (2S,3R)-2-[(Z)-3-methoxy-3-oxoprop-1-enyl]-3-phenylmethoxy-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-2-[(Z)-3-methoxy-3-oxoprop-1-enyl]-3-phenylmethoxypiperidine-1-carboxylate Traditional Name: (2S,3R)-3-benzoxy-2-[(Z)-3-keto-3-methoxy-prop-1-enyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H29NO5 MolecularWeight: 375.45866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1C=CC(=O)OC)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]1/C=C\C(=O)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C21H29NO5/c1-21(2,3)27-20(24)22-14-8-11-18(17(22)12-13-19(23)25-4)26-15-16-9-6-5-7-10-16/h5-7,9-10,12-13,17-18H,8,11,14-15H2,1-4H3/b13-12-/t17-,18+/m0/s1