tert-butyl (2R,6S)-2-[(E)-4-oxidanylidenepent-2-enyl]-6-[(2R)-2-oxidanylpentyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (2R,6S)-2-[(E)-4-oxidanylidenepent-2-enyl]-6-[(2R)-2-oxidanylpentyl]piperidine-1-carboxylate Openeye Name: tert-butyl (2S,6R)-2-[(2R)-2-hydroxypentyl]-6-[(E)-4-oxopent-2-enyl]piperidine-1-carboxylate CAS Name: (2S,6R)-2-[(2R)-2-hydroxypentyl]-6-[(E)-4-oxopent-2-enyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,6R)-2-[(2R)-2-hydroxypentyl]-6-[(E)-4-oxopent-2-enyl]piperidine-1-carboxylate Traditional Name: (2S,6R)-2-[(2R)-2-hydroxypentyl]-6-[(E)-4-ketopent-2-enyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H35NO4 MolecularWeight: 353.4962

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1CCCC(N1C(=O)OC(C)(C)C)CC=CC(=O)C)O

Isomeric SMILES

CCC[C@H](C[C@@H]1CCC[C@@H](N1C(=O)OC(C)(C)C)C/C=C/C(=O)C)O

InChI

InChI=1S/C20H35NO4/c1-6-9-18(23)14-17-13-8-12-16(11-7-10-15(2)22)21(17)19(24)25-20(3,4)5/h7,10,16-18,23H,6,8-9,11-14H2,1-5H3/b10-7+/t16-,17-,18+/m0/s1