1-chloranyl-2-methyl-1-pyridin-4-yl-hexadecan-3-one

Systemtic Name: 1-chloranyl-2-methyl-1-pyridin-4-yl-hexadecan-3-one Openeye Name: 1-chloro-2-methyl-1-(4-pyridyl)hexadecan-3-one CAS Name: 1-chloro-2-methyl-1-pyridin-4-yl-3-hexadecanone IUPAC Name: 1-chloro-2-methyl-1-pyridin-4-ylhexadecan-3-one Traditional Name: 1-chloro-2-methyl-1-(4-pyridyl)hexadecan-3-one Formula: C22H36ClNO MolecularWeight: 365.98034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)C(C)C(C1=CC=NC=C1)Cl

Isomeric SMILES

CCCCCCCCCCCCCC(=O)C(C)C(C1=CC=NC=C1)Cl

InChI

InChI=1S/C22H36ClNO/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(25)19(2)22(23)20-15-17-24-18-16-20/h15-19,22H,3-14H2,1-2H3