4-methyl-1-octadecyl-2-oxidanyl-6-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 4-methyl-1-octadecyl-2-oxidanyl-6-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 2-hydroxy-4-methyl-1-octadecyl-6-oxo-pyridine-3-carbonitrile CAS Name: 2-hydroxy-4-methyl-1-octadecyl-6-oxo-3-pyridinecarbonitrile IUPAC Name: 2-hydroxy-4-methyl-1-octadecyl-6-oxopyridine-3-carbonitrile Traditional Name: 2-hydroxy-6-keto-4-methyl-1-stearyl-nicotinonitrile Formula: C25H42N2O2 MolecularWeight: 402.61318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C(=O)C=C(C(=C1O)C#N)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C(=O)C=C(C(=C1O)C#N)C

InChI

InChI=1S/C25H42N2O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27-24(28)20-22(2)23(21-26)25(27)29/h20,29H,3-19H2,1-2H3