tert-butyl (2S)-2-[(E)-6-methoxy-1,6-bis(oxidanylidene)hex-3-en-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(E)-6-methoxy-1,6-bis(oxidanylidene)hex-3-en-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(E)-4-methoxy-4-oxo-1-(2-oxoethyl)but-1-enyl]piperidine-1-carboxylate CAS Name: (2S)-2-[(E)-6-methoxy-1,6-dioxohex-3-en-3-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(E)-6-methoxy-1,6-dioxohex-3-en-3-yl]piperidine-1-carboxylate Traditional Name: (2S)-2-[(E)-4-keto-1-(2-ketoethyl)-4-methoxy-but-1-enyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H27NO5 MolecularWeight: 325.39998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1C(=CCC(=O)OC)CC=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC[C@H]1/C(=C/CC(=O)OC)/CC=O

InChI

InChI=1S/C17H27NO5/c1-17(2,3)23-16(21)18-11-6-5-7-14(18)13(10-12-19)8-9-15(20)22-4/h8,12,14H,5-7,9-11H2,1-4H3/b13-8+/t14-/m0/s1