1-[5-(hydroxymethyl)-1H-pyrrol-2-yl]dodecan-1-one

Systemtic Name: 1-[5-(hydroxymethyl)-1H-pyrrol-2-yl]dodecan-1-one Openeye Name: 1-[5-(hydroxymethyl)-1H-pyrrol-2-yl]dodecan-1-one CAS Name: 1-[5-(hydroxymethyl)-1H-pyrrol-2-yl]-1-dodecanone IUPAC Name: 1-[5-(hydroxymethyl)-1H-pyrrol-2-yl]dodecan-1-one Traditional Name: 1-(5-methylol-1H-pyrrol-2-yl)dodecan-1-one Formula: C17H29NO2 MolecularWeight: 279.41766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=CC=C(N1)CO

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CC=C(N1)CO

InChI

InChI=1S/C17H29NO2/c1-2-3-4-5-6-7-8-9-10-11-17(20)16-13-12-15(14-19)18-16/h12-13,18-19H,2-11,14H2,1H3