4-[(2S,6S)-6-(2-oxidanylidenepropyl)piperidin-2-yl]butanal

Systemtic Name: 4-[(2S,6S)-6-(2-oxidanylidenepropyl)piperidin-2-yl]butanal Openeye Name: 4-[(2S,6S)-6-acetonyl-2-piperidyl]butanal CAS Name: 4-[(2S,6S)-6-(2-oxopropyl)-2-piperidinyl]butanal IUPAC Name: 4-[(2S,6S)-6-(2-oxopropyl)piperidin-2-yl]butanal Traditional Name: 4-[(2S,6S)-6-acetonyl-2-piperidyl]butyraldehyde Formula: C12H21NO2 MolecularWeight: 211.30064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1CCCC(N1)CCCC=O

Isomeric SMILES

CC(=O)C[C@@H]1CCC[C@H](N1)CCCC=O

InChI

InChI=1S/C12H21NO2/c1-10(15)9-12-7-4-6-11(13-12)5-2-3-8-14/h8,11-13H,2-7,9H2,1H3/t11-,12+/m1/s1