(4Z)-1-dodecyl-5-(hydroxymethyl)-2-methyl-4-(oxidanylmethylidene)-2H-pyridin-3-one bromide

Systemtic Name: (4Z)-1-dodecyl-5-(hydroxymethyl)-2-methyl-4-(oxidanylmethylidene)-2H-pyridin-3-one bromide Openeye Name: (4Z)-1-dodecyl-5-(hydroxymethyl)-4-(hydroxymethylene)-2-methyl-2H-pyridin-3-one bromide CAS Name: (4Z)-1-dodecyl-5-(hydroxymethyl)-4-(hydroxymethylidene)-2-methyl-2H-pyridin-3-one bromide IUPAC Name: (4Z)-1-dodecyl-5-(hydroxymethyl)-4-(hydroxymethylidene)-2-methyl-2H-pyridin-3-one bromide Traditional Name: (4Z)-4-(hydroxymethylene)-1-lauryl-2-methyl-5-methylol-2H-pyridin-3-one bromide Formula: C20H35BrNO3- MolecularWeight: 417.4008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C=C(C(=CO)C(=O)C1C)CO.[Br-]

Isomeric SMILES

CCCCCCCCCCCCN1C=C(/C(=C/O)/C(=O)C1C)CO.[Br-]

InChI

InChI=1S/C20H35NO3.BrH/c1-3-4-5-6-7-8-9-10-11-12-13-21-14-18(15-22)19(16-23)20(24)17(21)2;/h14,16-17,22-23H,3-13,15H2,1-2H3;1H/p-1/b19-16-;