(2E,4E)-1-[3-(hydroxymethyl)piperidin-1-yl]hexa-2,4-dien-1-one

Systemtic Name: (2E,4E)-1-[3-(hydroxymethyl)piperidin-1-yl]hexa-2,4-dien-1-one Openeye Name: (2E,4E)-1-[3-(hydroxymethyl)-1-piperidyl]hexa-2,4-dien-1-one CAS Name: (2E,4E)-1-[3-(hydroxymethyl)-1-piperidinyl]-1-hexa-2,4-dienone IUPAC Name: (2E,4E)-1-[3-(hydroxymethyl)piperidin-1-yl]hexa-2,4-dien-1-one Traditional Name: (2E,4E)-1-(3-methylolpiperidino)hexa-2,4-dien-1-one Formula: C12H19NO2 MolecularWeight: 209.28476

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)N1CCCC(C1)CO

Isomeric SMILES

C/C=C/C=C/C(=O)N1CCCC(C1)CO

InChI

InChI=1S/C12H19NO2/c1-2-3-4-7-12(15)13-8-5-6-11(9-13)10-14/h2-4,7,11,14H,5-6,8-10H2,1H3/b3-2+,7-4+