2-(bromomethyl)-1-[(4-dimethylaminophenyl)methyl]-5-octadecoxy-pyridin-4-one

Systemtic Name: 2-(bromomethyl)-1-[(4-dimethylaminophenyl)methyl]-5-octadecoxy-pyridin-4-one Openeye Name: 2-(bromomethyl)-1-[(4-dimethylaminophenyl)methyl]-5-octadecoxy-pyridin-4-one CAS Name: 2-(bromomethyl)-1-[(4-dimethylaminophenyl)methyl]-5-octadecoxy-4-pyridinone IUPAC Name: 2-(bromomethyl)-1-[(4-dimethylaminophenyl)methyl]-5-octadecoxypyridin-4-one Traditional Name: 2-(bromomethyl)-1-[4-(dimethylamino)benzyl]-5-stearyloxy-4-pyridone Formula: C33H53BrN2O2 MolecularWeight: 589.69012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CBr)CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CBr)CC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C33H53BrN2O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-38-33-28-36(31(26-34)25-32(33)37)27-29-20-22-30(23-21-29)35(2)3/h20-23,25,28H,4-19,24,26-27H2,1-3H3